Model name: model_name=EAM_Dynamo_MishinFarkasMehl_1999_Ni__MO_400591584784_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5199994325637833
cohesive_energy=4.4503499761477565
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -3.09700299259974e-11 eV

========================================
theta = 0.0
========================================

Energy: 0.018156188023250395
Energy: 1.3929756788979017
Energy: 0.018156188023250395
Energy: 1.3929756788972403
Energy: 0.018156188023250395
Energy: 1.3929756788979017
Energy: 1.3929756788972403
Energy: 1.5026304649725388
Energy: 1.3929756788979017
Energy: 1.5026304649728695
Energy: 1.392975678897571
Energy: 1.2222820550241145
Energy: 0.018156188023250395
Energy: 1.392975678897571
Energy: 0.018156188023250395
Energy: 1.3929756788972403
Energy: 0.018156188023250395
Energy: 1.392975678897571
Energy: 1.392975678897571
Energy: 1.5026304649728695
Energy: 1.3929756788979017
Energy: 1.5026304649728695
Energy: 1.392975678897571
Energy: 1.2222820550241145
Energy: 0.018156188023250395
Energy: 1.392975678897571
Energy: 0.018156188023250395
Energy: 1.392975678897571
Energy: 0.018156188023250395
Energy: 1.3929756788972403
Energy: 1.3929756788972403
Energy: 1.2222820550241145
Energy: 1.392975678897571
Energy: 1.2222820550237836
Energy: 1.3929756788979017
Energy: 1.2222820550241145

minimum gb energy = 0.018156188023250395 eV
minimum distance =  2.33922922064271 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.5869542750598118
Energy: 1.4979400553791253
Energy: 1.5869542750598118
Energy: 1.4979400553799216
Energy: 1.5869542750598118
Energy: 1.4979400553791253
Energy: 1.7403180395371054
Energy: 1.402427908921381
Energy: 1.7403180395402904
Energy: 1.402427908921381
Energy: 1.7403180395474558
Energy: 1.402427908921381
Energy: 1.5722006789344753
Energy: 1.5978553885877451
Energy: 1.5722006789289018
Energy: 1.5978553885869489
Energy: 1.5722006789344753
Energy: 1.5978553885877451
Energy: 1.7272218170140223
Energy: 1.4594619469564645
Energy: 1.72722181701243
Energy: 1.4594619469564645
Energy: 1.7272218170084492
Energy: 1.4594619469556684
Energy: 1.514146090974209
Energy: 1.5852205754708737
Energy: 1.514146090974209
Energy: 1.5852205754613191
Energy: 1.514146090974209
Energy: 1.5852205754637079
Energy: 1.6165212977869183
Energy: 1.4181059411562114
Energy: 1.6165212977869183
Energy: 1.4181059411562114
Energy: 1.6165212977877148
Energy: 1.4181059411562114
Energy: 1.4551153891373156
Energy: 1.5525567621704264
Energy: 1.4551153891365194
Energy: 1.5525567621696303
Energy: 1.4551153891357234
Energy: 1.5525567621680378
Energy: 1.4547580913012008
Energy: 1.6718107348861109
Energy: 1.4547580913019968
Energy: 1.6718107348932767
Energy: 1.4547580913019968
Energy: 1.6718107348892957
Energy: 1.6298000488127578
Energy: 1.5538995078613629
Energy: 1.6298000488127578
Energy: 1.5538995078613629
Energy: 1.6298000488127578
Energy: 1.5538995078621591
Energy: 1.378402530552707
Energy: 1.650544005635153
Energy: 1.3784025305542995
Energy: 1.6505440056255989
Energy: 1.378402530552707
Energy: 1.6505440056343568
Energy: 1.5970531302185191
Energy: 1.4166612526740632
Energy: 1.5970531302185191
Energy: 1.4166612526748592
Energy: 1.597053130217723
Energy: 1.4166612526748592
Energy: 1.3583908191586902
Energy: 1.4891435063082918
Energy: 1.3583908191586902
Energy: 1.4891435063329737
Energy: 1.3583908191586902
Energy: 1.489143506328993
Energy: 1.77259252555111
Energy: 1.3485360896968162
Energy: 1.7725925255479256
Energy: 1.3485360896968162
Energy: 1.7725925255455368
Energy: 1.3485360896968162
Energy: 1.4449625087554177
Energy: 1.4960101932842513
Energy: 1.4449625087546216
Energy: 1.4960101932850471
Energy: 1.4449625087546216
Energy: 1.4960101932858434
Energy: 1.7713239830070824
Energy: 1.3888477953405431
Energy: 1.771323983004766
Energy: 1.3888477953405431
Energy: 1.7713239830039702
Energy: 1.3888477953405431
Energy: 1.7641249064181814
Energy: 1.600228160618158
Energy: 1.7641249064205697
Energy: 1.6002281606173618
Energy: 1.7641249064197737
Energy: 1.6002281606149735
Energy: 1.5326352094373836
Energy: 1.5302191065982058
Energy: 1.53263520943818
Energy: 1.5302191065990018
Energy: 1.5326352094373836
Energy: 1.5302191065997983
Energy: 1.5327147171705569
Energy: 1.4784870440347517
Energy: 1.5327147171705569
Energy: 1.4784870440339555
Energy: 1.5327147171681685
Energy: 1.478487044035548
Energy: 1.5204760910011
Energy: 1.4583248747682218
Energy: 1.5204760910011
Energy: 1.4583248747682218
Energy: 1.5204760910011
Energy: 1.4583248747682218
Energy: 1.6185451585963877
Energy: 1.4180109585115879
Energy: 1.6185451585955917
Energy: 1.4180109585107916
Energy: 1.6185451585932034
Energy: 1.4180109585115879
Energy: 1.4249154525898695
Energy: 1.6813680603026058
Energy: 1.4249154525898695
Energy: 1.6813680602922556
Energy: 1.4249154525898695
Energy: 1.6813680603097716
Energy: 1.6111381265503184
Energy: 1.5556706922853094
Energy: 1.6111381265503184
Energy: 1.5556706922853094
Energy: 1.6111381265519107
Energy: 1.555670692284513
Energy: 1.3758181501109976
Energy: 1.700143045296093
Energy: 1.3758181501133864
Energy: 1.700143045296093
Energy: 1.3758181501102018
Energy: 1.700143045296093

minimum gb energy = 1.3485360896968162 eV
minimum distance =  2.27069612502466 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.644166529483088
Energy: 1.6840437070478744
Energy: 1.5806705327775323
Energy: 1.6840437070483276
Energy: 1.644166529483541
Energy: 1.6840437070519505
Energy: 1.6704270784580242
Energy: 1.4761214879839168
Energy: 1.6704270784629647
Energy: 1.4761214879839168
Energy: 1.670427078458477
Energy: 1.4761214879766709
Energy: 1.3897920019816499
Energy: 1.476030695096517
Energy: 1.3897920019834615
Energy: 1.4760306950969697
Energy: 1.3897920019816499
Energy: 1.4760306950956112
Energy: 1.7148774236025406
Energy: 1.674387231358924
Energy: 1.7148774236007291
Energy: 1.674387231359377
Energy: 1.7148774236016349
Energy: 1.6743872313616415
Energy: 1.5282986197691706
Energy: 1.5669504394590381
Energy: 1.5282986197691706
Energy: 1.5669504394585851
Energy: 1.5282986197691706
Energy: 1.5669504394658313
Energy: 1.5011934908039342
Energy: 1.3919839634996636
Energy: 1.50119349081118
Energy: 1.3919839634996636
Energy: 1.5011934908021227
Energy: 1.3919839634978521
Energy: 1.6851372330052832
Energy: 1.5813536985869752
Energy: 1.6851372330039245
Energy: 1.5813536985860692
Energy: 1.685137233006189
Energy: 1.5813536985838048
Energy: 1.3351730395480534
Energy: 1.6456261129230223
Energy: 1.335173039545336
Energy: 1.6456261129243808
Energy: 1.3351730395480534
Energy: 1.6456261129157765
Energy: 1.4220050555708312
Energy: 1.3933170907907662
Energy: 1.4220050555766772
Energy: 1.3933170907907662
Energy: 1.4220050555708312
Energy: 1.3933170907934835
Energy: 1.3619037097988127
Energy: 1.547706943782747
Energy: 1.361893030285752
Energy: 1.5477069437813886
Energy: 1.3619037097988127
Energy: 1.5477069437764068
Energy: 1.7552956987307329
Energy: 1.3658396043417949
Energy: 1.7552956987089952
Energy: 1.3658396043417949
Energy: 1.7552956986841286
Energy: 1.3658396043476824
Energy: 1.3892937208392002
Energy: 1.4797307614041109
Energy: 1.3892935619930273
Energy: 1.4797307614041109
Energy: 1.3892937208387472
Energy: 1.4797307613891661
Energy: 1.5832162437152377
Energy: 1.3832486329344678
Energy: 1.5832162437134263
Energy: 1.383248632933562
Energy: 1.5832162437170492
Energy: 1.3832486329312976
Energy: 1.5813253000164158
Energy: 1.6989577380270466
Energy: 1.5813253000164158
Energy: 1.6989577380270466
Energy: 1.5813253000164158
Energy: 1.6989577380148602
Energy: 1.5458399318505531
Energy: 1.4761745657786125
Energy: 1.5458399318491944
Energy: 1.4761745657786125
Energy: 1.5458399318505531
Energy: 1.4761745657790653
Energy: 1.3902482714500703
Energy: 1.4778246512616675
Energy: 1.3902482714487117
Energy: 1.4778246512603086
Energy: 1.3902482714500703
Energy: 1.4778246512548743
Energy: 1.741211757139776
Energy: 1.633148355532922
Energy: 1.7412117571406818
Energy: 1.6331483555324693
Energy: 1.741211757139776
Energy: 1.6331483555320163
Energy: 1.52811127675973
Energy: 1.3901978363251988
Energy: 1.5281112767606357
Energy: 1.3901978363251988
Energy: 1.5281112767592773
Energy: 1.390197836331086
Energy: 1.501496372718966
Energy: 1.5070438908218928
Energy: 1.501496372718966
Energy: 1.507043890820534
Energy: 1.501496372718966
Energy: 1.5070438908232513
Energy: 1.6865454780340987
Energy: 1.5851898285168025
Energy: 1.6865454780359104
Energy: 1.5851898285163495
Energy: 1.686545478033646
Energy: 1.5851898285122736
Energy: 1.3314265047435554
Energy: 1.6454546708945674
Energy: 1.3314265047476312
Energy: 1.6454546708945674
Energy: 1.3314265047435554
Energy: 1.6454546708977376
Energy: 1.47638326471333
Energy: 1.3944631223715527
Energy: 1.4763832647074426
Energy: 1.3944631223715527
Energy: 1.4763832647128772
Energy: 1.3944631223765345
Energy: 1.3612064983676562
Energy: 1.5449683872301618
Energy: 1.36120616855687
Energy: 1.544968387078533
Energy: 1.3612064983676562
Energy: 1.5449683864131016
Energy: 1.714892982096775
Energy: 1.5282656646045676
Energy: 1.7148929821040206
Energy: 1.5282656646041146
Energy: 1.7148929820945107
Energy: 1.528265664602756
Energy: 1.3893124000069366
Energy: 1.5012062958682342
Energy: 1.3893325100754348
Energy: 1.501206295865064
Energy: 1.3893124000069366
Energy: 1.5012062958677812
Energy: 1.6446643079652508
Energy: 1.6476020278826964
Energy: 1.5812967587948628
Energy: 1.6476020278822436
Energy: 1.6446643079616279
Energy: 1.6476020278849608
Energy: 1.6446480556092338
Energy: 1.6217680849570233
Energy: 1.5811878459361435
Energy: 1.6217680849556648
Energy: 1.6446480556087808
Energy: 1.6217680849480074
Energy: 1.3896869981518403
Energy: 1.4765965533879615
Energy: 1.3896869981477644
Energy: 1.4765965533906786
Energy: 1.3896869981518403
Energy: 1.476596553382527
Energy: 1.5451755267114728
Energy: 1.4757196154622692
Energy: 1.54517552670785
Energy: 1.4757196154613634
Energy: 1.54517552670785
Energy: 1.4757196154640806
Energy: 1.3611284799255383
Energy: 1.713857876017049
Energy: 1.3611284799210095
Energy: 1.713842882780614
Energy: 1.3611284799250853
Energy: 1.7135360324772664
Energy: 1.5282823839310233
Energy: 1.3935654107067172
Energy: 1.5282823839337403
Energy: 1.3935654107071702
Energy: 1.5282823839296644
Energy: 1.3935654107012827
Energy: 1.382402403637205
Energy: 1.581787992783912
Energy: 1.3824024036353935
Energy: 1.5817879927843648
Energy: 1.382402403637205
Energy: 1.5817879927816478
Energy: 1.6864652175155102
Energy: 1.5852508010184077
Energy: 1.686465217516416
Energy: 1.5852508010184077
Energy: 1.686465217516416
Energy: 1.585250801017955
Energy: 1.4785338512009853
Energy: 1.5454775455753602
Energy: 1.4785338512027968
Energy: 1.5454775455749072
Energy: 1.4785338512014383
Energy: 1.5454775455817005
Energy: 1.4777001286675855
Energy: 1.3904621020612824
Energy: 1.4777001286748315
Energy: 1.3904621020617354
Energy: 1.477700128666227
Energy: 1.3904621020540364
Energy: 1.6764498388090185
Energy: 1.7137080782813385
Energy: 1.6764498388180762
Energy: 1.7137080782817913
Energy: 1.6764498388090185
Energy: 1.713708078268205
Energy: 1.390486427335119
Energy: 1.5275130927702234
Energy: 1.3904964632130956
Energy: 1.527513092769318
Energy: 1.390486427334666
Energy: 1.5275130927670535
Energy: 1.507571262201334
Energy: 1.5000959136278915
Energy: 1.507571262195447
Energy: 1.5000959136292502
Energy: 1.5075712622008812
Energy: 1.5000959136292502
Energy: 1.581633818391203
Energy: 1.7018952580377162
Energy: 1.581633818388486
Energy: 1.7018952580381694
Energy: 1.5816338183921088
Energy: 1.7018952580426978
Energy: 1.6453525477254087
Energy: 1.332380917458694
Energy: 1.645352547723597
Energy: 1.332380917459147
Energy: 1.645352547723597
Energy: 1.3323809174519008
Energy: 1.3894056394419814
Energy: 1.4204010120851662
Energy: 1.3894056394446985
Energy: 1.4204010120856192
Energy: 1.3894056394415284
Energy: 1.420401012089242

minimum gb energy = 1.3314265047435554 eV
minimum distance =  2.36121442106489 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.5638573076051265
Energy: 1.5833789430203562
Energy: 1.5638573076040774
Energy: 1.5833789430203562
Energy: 1.5638573076051265
Energy: 1.5833789430203562
Energy: 1.6942759843048636
Energy: 1.4871990338234782
Energy: 1.6942759843069624
Energy: 1.487199033822429
Energy: 1.694275984305913
Energy: 1.4871990338234782
Energy: 1.478872912285692
Energy: 1.573815083477034
Energy: 1.4788729122846427
Energy: 1.5738150834759845
Energy: 1.4788729122846427
Energy: 1.5738150834822802
Energy: 1.5620256049338255
Energy: 1.362434642010487
Energy: 1.5620256049338255
Energy: 1.362434642010487
Energy: 1.5620256049348746
Energy: 1.362434642010487
Energy: 1.5787061740754886
Energy: 1.5046695557924008
Energy: 1.578706174076538
Energy: 1.5046695557924008
Energy: 1.578706174076538
Energy: 1.5046695557913516
Energy: 1.580955061652577
Energy: 1.5041558465862228
Energy: 1.5809550616536263
Energy: 1.5041558465862228
Energy: 1.580955061652577
Energy: 1.5041558465862228
Energy: 1.511474502577569
Energy: 1.504076959269204
Energy: 1.511474502577569
Energy: 1.504076959269204
Energy: 1.511474502577569
Energy: 1.504076959269204
Energy: 1.4319629398795437
Energy: 1.5057696870422685
Energy: 1.4319629398795437
Energy: 1.5057696870412194
Energy: 1.4319629398795437
Energy: 1.5057696870412194
Energy: 1.7927851404026862
Energy: 1.3579391250892598
Energy: 1.7927851404026862
Energy: 1.3579391250892598
Energy: 1.7927851404037358
Energy: 1.3579391250892598
Energy: 1.3953906242229952
Energy: 1.7977554738277863
Energy: 1.3953906242229952
Energy: 1.7977554738277863
Energy: 1.395390624221946
Energy: 1.7977554738288355
Energy: 1.667158305742121
Energy: 1.3662272759564407
Energy: 1.667158305742121
Energy: 1.3662272759564407
Energy: 1.667158305741072
Energy: 1.3662272759564407
Energy: 1.5640011694375275
Energy: 1.585868820992888
Energy: 1.5640011694375275
Energy: 1.585868820992888
Energy: 1.5640011694375275
Energy: 1.5858688209918386
Energy: 1.6901841102336381
Energy: 1.4836195011113824
Energy: 1.6901841102294413
Energy: 1.4836195011113824
Energy: 1.6901841102346877
Energy: 1.4836195011113824
Energy: 1.47897423930458
Energy: 1.4624483791821716
Energy: 1.47897423930458
Energy: 1.4624483791832208
Energy: 1.47897423930458
Energy: 1.4624483791821716
Energy: 1.5374566581587152
Energy: 1.5637988003874737
Energy: 1.537456658157666
Energy: 1.5637988003885228
Energy: 1.537456658157666
Energy: 1.5637988003874737
Energy: 1.5795937829560844
Energy: 1.5039677101641387
Energy: 1.5795937829571336
Energy: 1.5039677101641387
Energy: 1.579593782958183
Energy: 1.5039677101641387
Energy: 1.5808403439104215
Energy: 1.638319233208859
Energy: 1.580840343908323
Energy: 1.6383192332078096
Energy: 1.580840343908323
Energy: 1.638319233208859
Energy: 1.5569665630563094
Energy: 1.5045930341816955
Energy: 1.5569665630563094
Energy: 1.5045930341816955
Energy: 1.5569665630563094
Energy: 1.5045930341816955

minimum gb energy = 1.3579391250892598 eV
minimum distance =  2.27470232201133 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.3013936948512954
Energy: 1.3008195873178976
Energy: 1.3013936948519178
Energy: 1.3008195873178976
Energy: 1.3013936948519178
Energy: 1.30081958731852
Energy: 1.4518885630865686
Energy: 1.5759251722607108
Energy: 1.451888563087191
Energy: 1.5759251722613332
Energy: 1.451888563087191
Energy: 1.5759251722619556
Energy: 1.2265028490244692
Energy: 1.5750042016558587
Energy: 1.2265028490244692
Energy: 1.5750042016558587
Energy: 1.2265028490244692
Energy: 1.575004201658971
Energy: 1.3738820817141555
Energy: 1.2265096898231833
Energy: 1.3738820817129105
Energy: 1.2265096898231833
Energy: 1.3738820817135329
Energy: 1.2265096898231833
Energy: 1.2705611242483579
Energy: 1.299969098860763
Energy: 1.2705611242489803
Energy: 1.299969098860763
Energy: 1.2705611242489803
Energy: 1.299969098860763
Energy: 1.2705539115090432
Energy: 1.3001233632755989
Energy: 1.2705539115090432
Energy: 1.3001233632755989
Energy: 1.2705539115071762
Energy: 1.3001233632755989
Energy: 1.373663104857273
Energy: 1.2264311186079173
Energy: 1.3736631048566506
Energy: 1.2264311186079173
Energy: 1.3736631048566506
Energy: 1.2264311186079173
Energy: 1.22645335883175
Energy: 1.5749411721752395
Energy: 1.22645335883175
Energy: 1.5749411721733722
Energy: 1.2264533588311275
Energy: 1.5749411721752395
Energy: 1.4519876016882654
Energy: 1.5760550159183915
Energy: 1.4519876016888877
Energy: 1.5760550159190136
Energy: 1.4519876016882654
Energy: 1.5760550159190136
Energy: 1.3013936948512954
Energy: 1.30081958731852
Energy: 1.3013936948519178
Energy: 1.3008195873178976
Energy: 1.3013936948519178
Energy: 1.30081958731852
Energy: 1.4518885630878133
Energy: 1.5759251722607108
Energy: 1.451888563087191
Energy: 1.5759251722613332
Energy: 1.451888563087191
Energy: 1.5759251722613332
Energy: 1.2265028490244692
Energy: 1.5750042016552364
Energy: 1.2265028490244692
Energy: 1.5750042016558587
Energy: 1.2265028490250918
Energy: 1.5750042016583485
Energy: 1.3738820817141555
Energy: 1.2265096898231833
Energy: 1.3738820817141555
Energy: 1.2265096898231833
Energy: 1.3738820817141555
Energy: 1.2265096898231833
Energy: 1.2705611242477355
Energy: 1.299969098860763
Energy: 1.2705611242489803
Energy: 1.299969098860763
Energy: 1.2705611242483579
Energy: 1.299969098860763
Energy: 1.2705539115102882
Energy: 1.3001233632755989
Energy: 1.270553911508421
Energy: 1.3001233632755989
Energy: 1.2705539115090432
Energy: 1.3001233632755989
Energy: 1.3736631048560282
Energy: 1.226431118607295
Energy: 1.3736631048566506
Energy: 1.226431118607295
Energy: 1.3736631048560282
Energy: 1.226431118607295
Energy: 1.22645335883175
Energy: 1.5749411721752395
Energy: 1.2264533588311275
Energy: 1.5749411721733722
Energy: 1.22645335883175
Energy: 1.5749411721746172
Energy: 1.4519876016882654
Energy: 1.5760550159183915
Energy: 1.4519876016882654
Energy: 1.5760550159183915
Energy: 1.4519876016882654
Energy: 1.5760550159190136
Energy: 1.3013936948512954
Energy: 1.30081958731852
Energy: 1.3013936948519178
Energy: 1.30081958731852
Energy: 1.3013936948519178
Energy: 1.30081958731852
Energy: 1.4518885630865686
Energy: 1.5759251722613332
Energy: 1.451888563087191
Energy: 1.5759251722619556
Energy: 1.451888563087191
Energy: 1.5759251722613332
Energy: 1.2265028490244692
Energy: 1.5750042016552364
Energy: 1.2265028490250918
Energy: 1.5750042016564814
Energy: 1.2265028490244692
Energy: 1.5750042016595933
Energy: 1.3738820817129105
Energy: 1.2265096898231833
Energy: 1.3738820817135329
Energy: 1.2265096898231833
Energy: 1.3738820817141555
Energy: 1.2265096898231833
Energy: 1.2705611242483579
Energy: 1.299969098860763
Energy: 1.2705611242496024
Energy: 1.299969098860763
Energy: 1.2705611242483579
Energy: 1.299969098860763
Energy: 1.2705539115096658
Energy: 1.3001233632755989
Energy: 1.270553911508421
Energy: 1.3001233632762215
Energy: 1.2705539115090432
Energy: 1.3001233632755989
Energy: 1.373663104857273
Energy: 1.2264311186079173
Energy: 1.373663104857273
Energy: 1.2264311186079173
Energy: 1.3736631048566506
Energy: 1.2264311186079173
Energy: 1.22645335883175
Energy: 1.5749411721752395
Energy: 1.22645335883175
Energy: 1.5749411721739945
Energy: 1.22645335883175
Energy: 1.5749411721739945
Energy: 1.4519876016882654
Energy: 1.5760550159190136
Energy: 1.4519876016888877
Energy: 1.5760550159196363
Energy: 1.4519876016882654
Energy: 1.5760550159190136
Energy: 1.3013936948512954
Energy: 1.30081958731852
Energy: 1.3013936948512954
Energy: 1.3008195873178976
Energy: 1.3013936948519178
Energy: 1.30081958731852
Energy: 1.451888563087191
Energy: 1.5759251722607108
Energy: 1.4518885630865686
Energy: 1.5759251722613332
Energy: 1.4518885630865686
Energy: 1.5759251722613332
Energy: 1.2265028490244692
Energy: 1.5750042016552364
Energy: 1.2265028490244692
Energy: 1.5750042016564814
Energy: 1.2265028490244692
Energy: 1.5750042016583485

minimum gb energy = 1.226431118607295 eV
minimum distance =  2.2822082598303 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.2876207932197388
Energy: 1.2373239794116517
Energy: 1.2876207932197388
Energy: 1.2373239794116517
Energy: 1.2876207932197388
Energy: 1.2373239794116517
Energy: 1.4829409359358272
Energy: 1.3061540481271008
Energy: 1.4829409359358272
Energy: 1.3061540481271008
Energy: 1.482940935929729
Energy: 1.3061540481271008
Energy: 1.1867934613459405
Energy: 1.4737184342764362
Energy: 1.1867934613459405
Energy: 1.473718434277961
Energy: 1.1867934613459405
Energy: 1.473718434277961
Energy: 1.45750834268599
Energy: 1.1988210787449856
Energy: 1.45750834268599
Energy: 1.1988210787449856
Energy: 1.4575083426844655
Energy: 1.1988210787449856
Energy: 1.5225297951965038
Energy: 1.1990327740704776
Energy: 1.5225297951949794
Energy: 1.1990327740704776
Energy: 1.5225297951965038
Energy: 1.1990327740704776
Energy: 1.4688048093106811
Energy: 1.5440415455882956
Energy: 1.4688048093106811
Energy: 1.5440415455882956
Energy: 1.4688048093106811
Energy: 1.5440415455882956
Energy: 1.4156440524546934
Energy: 1.3090000424161967
Energy: 1.4156440524546934
Energy: 1.3090000424161967
Energy: 1.4156440524531688
Energy: 1.3090000424161967
Energy: 1.2843448356139688
Energy: 1.2422894570974294
Energy: 1.2843448356139688
Energy: 1.2422894570974294
Energy: 1.2843448356139688
Energy: 1.2422894570974294
Energy: 1.384881930787591
Energy: 1.3052985747431531
Energy: 1.3848819307906401
Energy: 1.3052986662616903
Energy: 1.3848819307891156
Energy: 1.30529842705322
Energy: 1.408091121382803
Energy: 1.4825519181578848
Energy: 1.4080911213843272
Energy: 1.4825519181594093
Energy: 1.4080911213843272
Energy: 1.4825519181578848
Energy: 1.2927650645307007
Energy: 1.1992267716443241
Energy: 1.2927650645322255
Energy: 1.1992267716443241
Energy: 1.4476403735105008
Energy: 1.1992267716443241
Energy: 1.523378284174326
Energy: 1.3854327559760384
Energy: 1.523378284174326
Energy: 1.3854327559760384
Energy: 1.523378284174326
Energy: 1.3854327559760384

minimum gb energy = 1.1867934613459405 eV
minimum distance =  2.26063378139412 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.2905645686299794
Energy: 1.2412523994762754
Energy: 1.29056456862959
Energy: 1.2412523994754188
Energy: 1.29056456862959
Energy: 1.2412523994762754
Energy: 1.3744834471588279
Energy: 1.2865948457198795
Energy: 1.3744834471678238
Energy: 1.2865948457198795
Energy: 1.3744834471665386
Energy: 1.2013703763118833
Energy: 1.1454210291206428
Energy: 1.419262990731552
Energy: 1.1454210291214995
Energy: 1.4192629907324088
Energy: 1.1454210291206428
Energy: 1.4192629907332655
Energy: 1.1597104330879717
Energy: 1.1196883058570737
Energy: 1.1597104330884
Energy: 1.1196883058579303
Energy: 1.1597104330871149
Energy: 1.119688305858787
Energy: 1.2479625413602342
Energy: 1.1986301683295384
Energy: 1.2479625413619477
Energy: 1.1986301683269682
Energy: 1.2479625413606625
Energy: 1.1986301683269682
Energy: 1.2621170989619468
Energy: 1.2816232348570014
Energy: 1.2621170989640886
Energy: 1.2816232348574297
Energy: 1.2621170989658022
Energy: 1.2963999573958374
Energy: 1.1841973512596884
Energy: 1.3127387010931608
Energy: 1.1841973512596884
Energy: 1.3127387010935894
Energy: 1.1841973512575465
Energy: 1.3127387010935894
Energy: 1.0845031094644413
Energy: 1.3056569747505877
Energy: 1.084503109462728
Energy: 1.3056569747505877
Energy: 1.0845031094644413
Energy: 1.305656974751016
Energy: 1.2869290854925541
Energy: 1.1984644254231012
Energy: 1.2869290854959812
Energy: 1.1984644254235295
Energy: 1.2869290855006934
Energy: 1.1984644254231012
Energy: 1.262872432229186
Energy: 1.2538112428105386
Energy: 1.2628724322296143
Energy: 1.253811242818249
Energy: 1.2628724322283291
Energy: 1.2538112428323853
Energy: 1.1596522248430319
Energy: 1.1250447582617444
Energy: 1.15965222484089
Energy: 1.1250447582613161
Energy: 1.1596522248430319
Energy: 1.1250447582613161
Energy: 1.180918783024978
Energy: 1.2667564184537707
Energy: 1.1809187830245496
Energy: 1.2667564184486302
Energy: 1.1809187830245496
Energy: 1.2667564184490585
Energy: 1.232136476760712
Energy: 1.2401379804596753
Energy: 1.2321364767615686
Energy: 1.2401379804601036
Energy: 1.2321364767589986
Energy: 1.2401379804605321
Energy: 1.2880124391245045
Energy: 1.2542254639938917
Energy: 1.2880124391227912
Energy: 1.2542254639913215
Energy: 1.2880124391223626
Energy: 1.25422546399432
Energy: 1.1391431454572234
Energy: 1.2664540481924997
Energy: 1.1391431454563665
Energy: 1.266454048192928
Energy: 1.139143145456795
Energy: 1.2664540481924997
Energy: 1.1606000537993078
Energy: 1.222001569099579
Energy: 1.1606000537993078
Energy: 1.222001569098294
Energy: 1.160600053797166
Energy: 1.222001569098722
Energy: 1.4608860482980086
Energy: 1.1202436276475431
Energy: 1.460886048297152
Energy: 1.1202436276479715
Energy: 1.4608860482980086
Energy: 1.1202436276484
Energy: 1.1538726792554759
Energy: 1.1980538446541955
Energy: 1.153872679255904
Energy: 1.198053844654624
Energy: 1.1538726792546192
Energy: 1.198053844654624
Energy: 1.0804043160587757
Energy: 1.4507013254781655
Energy: 1.0804043160587757
Energy: 1.4507013254781655
Energy: 1.080404316059204
Energy: 1.450701325478594
Energy: 1.3697338229734046
Energy: 1.2153247993733194
Energy: 1.3697338229742613
Energy: 1.2153247993720342
Energy: 1.369733822975975
Energy: 1.108606870351119
Energy: 1.0800151795460813
Energy: 1.450771098333307
Energy: 1.0800151795477946
Energy: 1.450771098333307
Energy: 1.0800151795460813
Energy: 1.450771098333307
Energy: 1.1534083725805107
Energy: 1.1980021826771408
Energy: 1.1534083725809392
Energy: 1.1980021826788538
Energy: 1.153408372579226
Energy: 1.1980021826784255
Energy: 1.4609150509367803
Energy: 1.1197769118935892
Energy: 1.4609150509380655
Energy: 1.1197769118935892
Energy: 1.4609150509380655
Energy: 1.1197769118931606
Energy: 1.160973343437907
Energy: 1.1851773404169972
Energy: 1.1609733434387637
Energy: 1.1851773404178538
Energy: 1.1609733434387637
Energy: 1.1851773404165686
Energy: 1.1392292504459052
Energy: 1.2668164609826822
Energy: 1.139229250446762
Energy: 1.2668164609813972
Energy: 1.1392292504450483
Energy: 1.266816460982254
Energy: 1.288139288873249
Energy: 1.2543233545733121
Energy: 1.2881392888719638
Energy: 1.2543233545741688
Energy: 1.2881392888723924
Energy: 1.2543233545733121
Energy: 1.2324670250093515
Energy: 1.2404752660911138
Energy: 1.232467025006781
Energy: 1.2404752660915424
Energy: 1.2324670250059244
Energy: 1.2404752660915424
Energy: 1.180914572997963
Energy: 1.1948152201076352
Energy: 1.1809145729971067
Energy: 1.1353466043642837
Energy: 1.1809145729966781
Energy: 1.1948152201076352
Energy: 1.1628122208926341
Energy: 1.1253473302151085
Energy: 1.162812220895204
Energy: 1.1253473302151085
Energy: 1.162812220893919
Energy: 1.1253473302151085
Energy: 1.262691915818568
Energy: 1.1643098995459322
Energy: 1.2626919158164263
Energy: 1.1643098995557846
Energy: 1.262691915809183
Energy: 1.1643098995600683
Energy: 1.287401380391951
Energy: 1.1984844225097058
Energy: 1.2874013803868105
Energy: 1.1984844225097058
Energy: 1.2874013803898094
Energy: 1.1984844225097058
Energy: 1.0845731517259147
Energy: 1.3054945713876849
Energy: 1.0845731517250579
Energy: 1.3054945713868278
Energy: 1.0845731517259147
Energy: 1.3054945713885415
Energy: 1.184256139485289
Energy: 1.3126249102594112
Energy: 1.184256139485289
Energy: 1.3126249102602678
Energy: 1.1842561394865743
Energy: 1.3126249102598395
Energy: 1.2620479843163028
Energy: 1.1743877536968355
Energy: 1.2620479843167312
Energy: 1.174387753698549
Energy: 1.2620479843154462
Energy: 1.1743877536964071
Energy: 1.2477003489539675
Energy: 1.1982925344873936
Energy: 1.2477003489565377
Energy: 1.198292534487822
Energy: 1.247700348954396
Energy: 1.198292534489107
Energy: 1.1590817907970743
Energy: 1.119456166236175
Energy: 1.1590817907987878
Energy: 1.1194561662366034
Energy: 1.159081790796646
Energy: 1.119456166236175
Energy: 1.1452979385139448
Energy: 1.418610680843554
Energy: 1.1452979385148014
Energy: 1.4186106808285608
Energy: 1.1452979385135162
Energy: 1.4186106808251338
Energy: 1.3754911471456397
Energy: 1.2666438480319424
Energy: 1.3754911471490667
Energy: 1.266643848030229
Energy: 1.3754911471499236
Energy: 1.2666438480306572
Energy: 1.2905645686321214
Energy: 1.241252399474562
Energy: 1.2905645686321214
Energy: 1.2412523994749902
Energy: 1.2905645686316929
Energy: 1.2412523994741336
Energy: 1.3744834471738208
Energy: 1.2059340023631164
Energy: 1.374483447168252
Energy: 1.205934002363545
Energy: 1.3744834471729641
Energy: 1.2059340023626879
Energy: 1.1454210291193576
Energy: 1.419262990731552
Energy: 1.145421029118501
Energy: 1.4192629907332655
Energy: 1.145421029118501
Energy: 1.419262990731552
Energy: 1.159710433089257
Energy: 1.1196883058557885
Energy: 1.1597104330871149
Energy: 1.1196883058570737
Energy: 1.1597104330871149
Energy: 1.1196883058557885
Energy: 1.2479625413640898
Energy: 1.1986301683265397
Energy: 1.2479625413658029
Energy: 1.1986301683248264
Energy: 1.2479625413649462
Energy: 1.1986301683269682

minimum gb energy = 1.0800151795460813 eV
minimum distance =  2.32824785620697 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.7355547365514198
Energy: 0.7101479511433791
Energy: 0.5636711297222682
Energy: 0.7101479511433791
Energy: 0.7355547365504447
Energy: 0.710147951141429
Energy: 0.8974327230267246
Energy: 0.6987066479648283
Energy: 0.8974327230237992
Energy: 0.6987066479658034
Energy: 0.8974327230267246
Energy: 0.6987066479697039
Energy: 0.7798362796898188
Energy: 1.1369679572484659
Energy: 0.7798362796868935
Energy: 1.1369679572484659
Energy: 0.7798362796898188
Energy: 1.1369679572504163
Energy: 0.7123846353539762
Energy: 0.563190328616693
Energy: 0.7123846353500757
Energy: 0.563190328616693
Energy: 0.7123846353539762
Energy: 0.5631903286186433
Energy: 0.7562700839946703
Energy: 0.9052673796791895
Energy: 0.7562700839995459
Energy: 0.9052673796791895
Energy: 0.7562700839946703
Energy: 0.9052673796801646
Energy: 0.5638829156156328
Energy: 0.7799317275545574
Energy: 0.5638829156136826
Energy: 0.7799317275545574
Energy: 0.5638829156156328
Energy: 0.7799317275467564
Energy: 0.5636989257475186
Energy: 0.6420554272665404
Energy: 0.5636989257436179
Energy: 0.642055427263615
Energy: 0.5636989257475186
Energy: 0.642055427263615
Energy: 0.8976606264131445
Energy: 0.7642369820161111
Energy: 0.8976606264141197
Energy: 0.7642369820161111
Energy: 0.8976606264131445
Energy: 0.764236982022937
Energy: 0.7119560717512641
Energy: 0.5631746674389565
Energy: 0.711956071750289
Energy: 0.5631746674389565
Energy: 0.7119560717512641
Energy: 0.5631746674311554
Energy: 0.641793399626469
Energy: 0.8846294073594864
Energy: 0.6417933996274442
Energy: 0.8846294073594864
Energy: 0.641793399626469
Energy: 0.8846294073633869
Energy: 0.7563098369403315
Energy: 0.9021643718361508
Energy: 0.7563098369393563
Energy: 0.9021643718361508
Energy: 0.7563098369403315
Energy: 0.9021643718342005
Energy: 0.7355547365494698
Energy: 0.710147951141429
Energy: 0.5636711297222682
Energy: 0.710147951141429
Energy: 0.7355547365484946
Energy: 0.7101479511394788
Energy: 0.8974327230286749
Energy: 0.6987066479648283
Energy: 0.8974327230267246
Energy: 0.6987066479648283
Energy: 0.8974327230286749
Energy: 0.6987066479677536
Energy: 0.7798362796878687
Energy: 1.1369679572543168
Energy: 0.7798362796849876
Energy: 1.1369679572484659
Energy: 0.7798362796878687
Energy: 1.1369679572445655
Energy: 0.712384635352026
Energy: 0.563190328616693
Energy: 0.7123846353481254
Energy: 0.563190328616693
Energy: 0.712384635352026
Energy: 0.5631903286196184
Energy: 0.7562700839936952
Energy: 0.9052673796791895
Energy: 0.7562700839946703
Energy: 0.9052673796791895
Energy: 0.7562700839936952
Energy: 0.9052673796801646
Energy: 0.5638829156146576
Energy: 0.779931727550657
Energy: 0.5638829156136826
Energy: 0.779931727550657
Energy: 0.5638829156146576
Energy: 0.7799317275448063
Energy: 0.5636989257465433
Energy: 0.6420554272606896
Energy: 0.5636989257445931
Energy: 0.6420554272626399
Energy: 0.5636989257465433
Energy: 0.6420554272597145
Energy: 0.8976606264121694
Energy: 0.7642369820190364
Energy: 0.8976606264131445
Energy: 0.7642369820190364
Energy: 0.8976606264121694
Energy: 0.7642369820239122

minimum gb energy = 0.5631746674311554 eV
minimum distance =  2.41112050316943 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.1270987520262417
Energy: 1.224673985000439
Energy: 1.1270987520262417
Energy: 1.2246739850011532
Energy: 1.1270987520276703
Energy: 1.2246739850011532
Energy: 1.2633380707447166
Energy: 1.16728613996006
Energy: 1.2633380707447166
Energy: 1.16728613996006
Energy: 1.2633380707447166
Energy: 1.1672861399593457
Energy: 1.2656917168314452
Energy: 1.6644139572977634
Energy: 1.2392874842623511
Energy: 1.664413957296335
Energy: 1.2392874842623511
Energy: 1.6644139572956207
Energy: 1.3814830613553692
Energy: 0.994938426134245
Energy: 1.3814830613575124
Energy: 0.994938426134245
Energy: 1.3814830613553692
Energy: 0.9949384261349593
Energy: 1.1639965029571147
Energy: 0.9535056363816448
Energy: 1.1639965029578287
Energy: 0.9535056363816448
Energy: 1.1639965029571147
Energy: 0.9535056363816448
Energy: 1.1443170518314312
Energy: 1.0716787488368564
Energy: 1.1443170518307169
Energy: 1.0716787488375707
Energy: 1.1443170518300025
Energy: 1.0716787488375707
Energy: 0.9500807062366414
Energy: 1.368704126967488
Energy: 0.9500807062352129
Energy: 1.3687041269589166
Energy: 0.9500807062366414
Energy: 1.3687041269539162
Energy: 1.2203739320885199
Energy: 0.9155507093842793
Energy: 1.2203739320878058
Energy: 0.9155507093857078
Energy: 1.2203739320863771
Energy: 0.9155507093857078
Energy: 1.2037819475701164
Energy: 0.9202424116013238
Energy: 1.2037819475708305
Energy: 0.9202424116006095
Energy: 1.203781947572259
Energy: 0.9202424116006095
Energy: 0.9424128427922421
Energy: 1.4365791016811948
Energy: 0.9424128427936707
Energy: 1.4365791016811948
Energy: 0.9424128427929565
Energy: 1.4365791016811948
Energy: 1.414585353318504
Energy: 1.4456098678650173
Energy: 1.4145853533163608
Energy: 1.445609867864303
Energy: 1.4145853533170756
Energy: 1.4456098678650173
Energy: 1.1659449418125094
Energy: 0.9565789344405404
Energy: 1.1659449418132235
Energy: 0.9565789344398262
Energy: 1.1659449418132235
Energy: 0.9565789344398262
Energy: 1.2356108570661781
Energy: 1.0018433632537875
Energy: 1.235610857067607
Energy: 1.0018433632537875
Energy: 1.235610857068321
Energy: 1.0018433632537875
Energy: 1.2942258576669432
Energy: 1.629031778311287
Energy: 1.2942258576662289
Energy: 1.6290317783120016
Energy: 1.2942258576655146
Energy: 1.6290317783127157
Energy: 1.5230202642062078
Energy: 1.1679572085261734
Energy: 1.5230202642040649
Energy: 1.1679572085261734
Energy: 1.5230202642040649
Energy: 1.1679572085254588
Energy: 1.03045751328693
Energy: 1.2094326467104901
Energy: 1.0304575132883589
Energy: 1.2094326467104901
Energy: 1.0304575132876443
Energy: 1.2094326467097758
Energy: 1.086348865131626
Energy: 1.1701325745564564
Energy: 1.086348865131626
Energy: 1.1701325745564564
Energy: 1.0863488651330548
Energy: 1.1701325745564564
Energy: 1.502974321013992
Energy: 1.4485312258816618
Energy: 1.5029743210132778
Energy: 1.4485312258809473
Energy: 1.5029743210132778
Energy: 1.4485312258809473
Energy: 1.3900957710484412
Energy: 0.9895384054340989
Energy: 1.3900957710477269
Energy: 0.9895384054348132
Energy: 1.3900957710477269
Energy: 0.9895384054348132
Energy: 1.1654581560599873
Energy: 1.0947647479112486
Energy: 1.16545815606213
Energy: 1.0947647479112486
Energy: 1.16545815606213
Energy: 1.0947647479112486
Energy: 0.9424269534155789
Energy: 1.0734624240032562
Energy: 0.9424269534141504
Energy: 1.0734624240025419
Energy: 0.9424269534155789
Energy: 1.0734624240032562
Energy: 1.2458738271717191
Energy: 1.3668549037940176
Energy: 1.2458738271702907
Energy: 1.3668549037875888
Energy: 1.2458738271702907
Energy: 1.3668549037897315
Energy: 1.2219496381714607
Energy: 1.1062148012391497
Energy: 1.2219496381736037
Energy: 1.1062148012391497
Energy: 1.221949638172175
Energy: 1.1062148012391497
Energy: 1.202271724532347
Energy: 1.0599328297033392
Energy: 1.202271724531633
Energy: 1.0599328297033392
Energy: 1.202271724531633
Energy: 1.0599328297033392
Energy: 0.9424908467498502
Energy: 1.4328814304137576
Energy: 0.9424908467512787
Energy: 1.4328814304144717
Energy: 0.9424908467498502
Energy: 1.432881430413043
Energy: 1.690197878950437
Energy: 1.4496285661777313
Energy: 1.6901978789497227
Energy: 1.449628566177017
Energy: 1.6901978789511514
Energy: 1.4496285661777313

minimum gb energy = 0.9155507093842793 eV
minimum distance =  2.31110135138315 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.2630846520554202
Energy: 1.0761993856018914
Energy: 1.263084652055983
Energy: 1.0761993856024548
Energy: 1.2630846520554202
Energy: 1.0761993856018914
Energy: 1.3370286009043766
Energy: 1.3754573137417723
Energy: 1.3370286009032508
Energy: 1.3754573137423352
Energy: 1.3370286009049397
Energy: 1.3754573137417723
Energy: 1.211287094018398
Energy: 1.8785380357784618
Energy: 1.211287094018398
Energy: 1.8785380357784618
Energy: 1.2112870940195242
Energy: 1.8785380357790245
Energy: 1.2337096774504188
Energy: 1.0612673925564917
Energy: 1.2337096774509817
Energy: 1.0612673925564917
Energy: 1.2337096774515448
Energy: 1.0612673925564917
Energy: 1.0264594739201085
Energy: 1.1202300781266388
Energy: 1.0264594739201085
Energy: 1.1202300781266388
Energy: 1.0264594739195458
Energy: 1.1202300781266388
Energy: 1.3045963123287252
Energy: 1.279000178215084
Energy: 1.304596312327036
Energy: 1.279000178215084
Energy: 1.304596312328162
Energy: 1.279000178214521
Energy: 1.051114376143011
Energy: 1.4727119224873446
Energy: 1.051114376143011
Energy: 1.4727119224873446
Energy: 1.051114376143574
Energy: 1.4727119224879075
Energy: 1.0251189219604528
Energy: 1.0614751740951431
Energy: 1.025118921961016
Energy: 1.0614751740951431
Energy: 1.0251189219604528
Energy: 1.0614751740951431
Energy: 1.0362609930778164
Energy: 1.0926271878219775
Energy: 1.0362609930783793
Energy: 1.0926271878225406
Energy: 1.0362609930783793
Energy: 1.0926271878225406
Energy: 1.1244030258954976
Energy: 1.5841436668718867
Energy: 1.1244030258949347
Energy: 1.5841436668724498
Energy: 1.1244030258949347
Energy: 1.5841436668724498
Energy: 1.1242810203920457
Energy: 1.5848699412477345
Energy: 1.1242810203920457
Energy: 1.5848699412477345
Energy: 1.124281020391483
Energy: 1.5848699412471714
Energy: 1.0179676440417336
Energy: 1.2341962611811115
Energy: 1.0179676440428596
Energy: 1.2341962611811115
Energy: 1.0179676440428596
Energy: 1.2341962611811115
Energy: 1.0251173257349728
Energy: 1.0593684492849704
Energy: 1.02511732573441
Energy: 1.0593684492855333
Energy: 1.0251173257349728
Energy: 1.0593684492855333
Energy: 0.9866293489892927
Energy: 1.4663539429786234
Energy: 0.9866293489881667
Energy: 1.4663539429803123
Energy: 0.9866293489892927
Energy: 1.4663539429803123
Energy: 1.3029586846426908
Energy: 1.5454741958024465
Energy: 1.3029586846432537
Energy: 1.5454741958024465
Energy: 1.3029586846426908
Energy: 1.5454741958024465
Energy: 0.986742291350154
Energy: 1.387694606561604
Energy: 0.986742291349591
Energy: 1.387694606559915
Energy: 0.986742291350154
Energy: 1.387694606559915
Energy: 1.034038553968524
Energy: 1.0594772557627061
Energy: 1.0340385539690868
Energy: 1.0594772557627061
Energy: 1.0340385539673977
Energy: 1.0594772557627061
Energy: 1.3024222626658921
Energy: 1.5603337148756249
Energy: 1.302422262667018
Energy: 1.560333714880692
Energy: 1.3024222626653292
Energy: 1.560333714873936
Energy: 1.1525794757962184
Energy: 1.3715686635324658
Energy: 1.1525794757962184
Energy: 1.3715686635319029
Energy: 1.1525794757950925
Energy: 1.3715686635324658
Energy: 1.1238242256900353
Energy: 1.1692483967397858
Energy: 1.1238242256894724
Energy: 1.1692483967403489
Energy: 1.1238242256900353
Energy: 1.1692483967397858
Energy: 1.0347956239727891
Energy: 1.36420278385461
Energy: 1.0347956239733522
Energy: 1.3642027838540471
Energy: 1.0347956239739151
Energy: 1.3642027838540471
Energy: 1.2130421442416113
Energy: 1.7247629110296407
Energy: 1.2130421442438633
Energy: 1.7247629110296407
Energy: 1.2130421442410482
Energy: 1.7247629110307665
Energy: 1.2356359290300214
Energy: 1.0609481272459251
Energy: 1.2356359290300214
Energy: 1.0609481272464882
Energy: 1.2356359290294585
Energy: 1.0609481272464882
Energy: 0.9854272934118915
Energy: 1.2372893299432595
Energy: 0.9854272934124545
Energy: 1.2372893299432595
Energy: 0.9854272934124545
Energy: 1.2372893299432595
Energy: 0.9858965374774862
Energy: 1.4613110230903064
Energy: 0.9858965374752341
Energy: 1.4613110230903064
Energy: 0.9858965374769231
Energy: 1.4613110230903064
Energy: 1.049845675242588
Energy: 1.4633782152112624
Energy: 1.049845675243714
Energy: 1.4633782152106993
Energy: 1.049845675243714
Energy: 1.4633782152118255
Energy: 1.029317737774135
Energy: 1.061019548776758
Energy: 1.029317737774135
Energy: 1.0610195487761949
Energy: 1.029317737773572
Energy: 1.061019548776758
Energy: 1.0336594653855016
Energy: 1.215680776875663
Energy: 1.0336594653849387
Energy: 1.215680776875663
Energy: 1.0336594653849387
Energy: 1.2156807768751001
Energy: 1.1239228531994192
Energy: 1.3816461830701305
Energy: 1.123922853202234
Energy: 1.3816461830695677
Energy: 1.123922853200545
Energy: 1.3816461830695677
Energy: 1.2429583038027587
Energy: 1.4113039868770638
Energy: 1.242958303799381
Energy: 1.4113039868770638
Energy: 1.2429583038038847
Energy: 1.4113039868770638
Energy: 1.0117898524681368
Energy: 1.2335633577302008
Energy: 1.0117898524692628
Energy: 1.2335633577296379
Energy: 1.0117898524681368
Energy: 1.2335633577296379
Energy: 1.0528637292478615
Energy: 1.1028650559533413
Energy: 1.0528637292472987
Energy: 1.1028650559533413
Energy: 1.0528637292478615
Energy: 1.1028650559533413
Energy: 0.9938332182249879
Energy: 1.2631910399900277
Energy: 0.993833218226114
Energy: 1.2631910399894648
Energy: 0.993833218226114
Energy: 1.2631910399894648

minimum gb energy = 0.9854272934118915 eV
minimum distance =  2.34512935974908 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.218899928910839
Energy: 1.139409072105826
Energy: 1.2188999289112703
Energy: 1.139409072105826
Energy: 1.21889992891048
Energy: 1.1394090721053949
Energy: 1.2282337043598175
Energy: 1.0322019729958374
Energy: 1.2282337043637686
Energy: 1.0322019729950471
Energy: 1.2282337043641998
Energy: 1.0322019729958374
Energy: 1.1342492584776647
Energy: 1.267854193997696
Energy: 1.1342492584780957
Energy: 1.2678541939972652
Energy: 1.1342492584773054
Energy: 1.2678541939961157
Energy: 1.1198973754671644
Energy: 1.0811547925658553
Energy: 1.119897375468745
Energy: 1.0811547925654958
Energy: 1.1198973754663744
Energy: 1.081154792565065
Energy: 1.1090448846997774
Energy: 1.140711873039973
Energy: 1.1090448846993461
Energy: 1.1407118730312804
Energy: 1.1090448846985559
Energy: 1.1407118730391828
Energy: 1.454340355537644
Energy: 1.1107706211392854
Energy: 1.4543403555368537
Energy: 1.1107706211400756
Energy: 1.4543403555352732
Energy: 1.1107706211397166
Energy: 1.0946514731643422
Energy: 1.2047014190937053
Energy: 1.0946514731639112
Energy: 1.204701419092556
Energy: 1.0946514731643422
Energy: 1.2047014190941365
Energy: 1.1654656330436888
Energy: 1.160336617129318
Energy: 1.1654656330452693
Energy: 1.1603366171289586
Energy: 1.16546563304412
Energy: 1.160336617129318
Energy: 1.1163219093392427
Energy: 1.1265924561651288
Energy: 1.1163219093368721
Energy: 1.1265924561651288
Energy: 1.1163219093380214
Energy: 1.1265924561651288
Energy: 1.5314766317169444
Energy: 1.0814515431270015
Energy: 1.5314766317169444
Energy: 1.0814515431274327
Energy: 1.531476631713424
Energy: 1.0814515431270015
Energy: 1.162178343923223
Energy: 1.1595740233592564
Energy: 1.1621783439248035
Energy: 1.1595740233584662
Energy: 1.1621783439184816
Energy: 1.1595740233596155
Energy: 1.7321142035257255
Energy: 1.081127066599046
Energy: 1.7321142035257255
Energy: 1.0811270665986867
Energy: 1.7321142035265154
Energy: 1.081127066599477
Energy: 1.1328945631409966
Energy: 1.1159929710002454
Energy: 1.1328945631402065
Energy: 1.1159929709966534
Energy: 1.1328945631394163
Energy: 1.115992971002185
Energy: 1.160829040141943
Energy: 1.1706439254058278
Energy: 1.160829040142733
Energy: 1.1706439254058278
Energy: 1.1608290401411527
Energy: 1.1706439254054688
Energy: 1.1678402024959467
Energy: 1.0924139151898047
Energy: 1.167840202496737
Energy: 1.0924139151898047
Energy: 1.1678402024963057
Energy: 1.092413915190164
Energy: 1.115792591188279
Energy: 1.4501591293095855
Energy: 1.1157925911906494
Energy: 1.4501591293087952
Energy: 1.1157925911890691
Energy: 1.4501591293087952
Energy: 1.4155829836149976
Energy: 1.118399888850496
Energy: 1.4155829836007736
Energy: 1.118399888850855
Energy: 1.4155829836418652
Energy: 1.118399888850496
Energy: 1.0759310482355375
Energy: 1.1254511543653822
Energy: 1.0759310482355375
Energy: 1.1254511543661725
Energy: 1.0759310482375488
Energy: 1.1254511543649512
Energy: 1.2717991051888469
Energy: 1.1332885192576443
Energy: 1.2717991051888469
Energy: 1.1332885192572133
Energy: 1.2717991051943784
Energy: 1.1332885192584343
Energy: 1.399205757148392
Energy: 1.1281404243008877
Energy: 1.3992057571479612
Energy: 1.1281404243008877
Energy: 1.3992057571487513
Energy: 1.128140424301678
Energy: 1.0703597462811258
Energy: 1.218229652436426
Energy: 1.0703597462803356
Energy: 1.2182296524359948
Energy: 1.0703597462803356
Energy: 1.218229652436426
Energy: 1.0418088525922855
Energy: 1.2292071851926736
Energy: 1.0418088525910643
Energy: 1.2292071851926736
Energy: 1.0418088525910643
Energy: 1.2292071851930326
Energy: 1.1684219510533744
Energy: 1.3890826205719953
Energy: 1.168421951051794
Energy: 1.389082620571564
Energy: 1.1684219510565352
Energy: 1.389082620571564
Energy: 1.0724092163367724
Energy: 1.1204239077302618
Energy: 1.0724092163379935
Energy: 1.1204239077302618
Energy: 1.0724092163379935
Energy: 1.1204239077302618
Energy: 1.1442271802467758
Energy: 1.0720353154914266
Energy: 1.1442271802317616
Energy: 1.0720353154906366
Energy: 1.1442271802487873
Energy: 1.0720353154906366
Energy: 1.110103014295624
Energy: 1.449765359871876
Energy: 1.110103014295265
Energy: 1.4497653598715168
Energy: 1.1101030142964143
Energy: 1.4497653598738873
Energy: 1.228762502607128
Energy: 1.0991956729661687
Energy: 1.2287625026087083
Energy: 1.0991956729661687
Energy: 1.2287625026082776
Energy: 1.0991956729661687
Energy: 1.2016380087193452
Energy: 1.070583883886175
Energy: 1.2016380087197045
Energy: 1.0705838838857438
Energy: 1.201638008722506
Energy: 1.070583883886175
Energy: 1.1267325159892845
Energy: 1.1173066198783663
Energy: 1.126732515987704
Energy: 1.1173066198814554
Energy: 1.1267325159920143
Energy: 1.1173066198783663
Energy: 1.0757953648724319
Energy: 1.5266519080100696
Energy: 1.0757953648712104
Energy: 1.5266519080100696
Energy: 1.075795364872791
Energy: 1.5266519080100696
Energy: 1.1197497304829813
Energy: 1.0693477541710534
Energy: 1.1197497304810415
Energy: 1.0693477541718437
Energy: 1.1197497304806108
Energy: 1.0693477541710534
Energy: 1.0723993809565442
Energy: 1.7384519653570512
Energy: 1.0723993809577654
Energy: 1.7384519653582007
Energy: 1.0723993809573344
Energy: 1.7384519653578414
Energy: 1.3992251187389149
Energy: 1.1403296353055792
Energy: 1.3992251187392741
Energy: 1.1403296353060102
Energy: 1.399225118738484
Energy: 1.1403296353055792
Energy: 1.1643778973668544
Energy: 1.1761710436646917
Energy: 1.1643778973672856
Energy: 1.1761710436642607
Energy: 1.164377897368866
Energy: 1.1761710436642607
Energy: 1.1643026773375664
Energy: 1.1756975317117697
Energy: 1.164302677335555
Energy: 1.1756975317121288
Energy: 1.1643026773367762
Energy: 1.1756975317121288
Energy: 1.3990183244123855
Energy: 1.140780430496283
Energy: 1.3990183244131758
Energy: 1.1407804304954927
Energy: 1.3990183244131758
Energy: 1.140780430496283
Energy: 1.0721582498634241
Energy: 1.7381656928926197
Energy: 1.072158249863855
Energy: 1.7381656928921887
Energy: 1.0721582498642144
Energy: 1.7381656928918297
Energy: 1.1195479685521788
Energy: 1.0694296605806886
Energy: 1.119547968552969
Energy: 1.0694296605798983
Energy: 1.1195479685470062
Energy: 1.0694296605798983
Energy: 1.0757686039910526
Energy: 1.5264834453889002
Energy: 1.0757686039886818
Energy: 1.5264834453896186
Energy: 1.0757686039886818
Energy: 1.5264834453889002
Energy: 1.1264341725915306
Energy: 1.1191850013902367
Energy: 1.1264341725919615
Energy: 1.1191850011714157
Energy: 1.1264341725919615
Energy: 1.1191850010564737
Energy: 1.2012123586340724
Energy: 1.087411843748348
Energy: 1.2012123586340724
Energy: 1.0874118437475577
Energy: 1.2012123586332821
Energy: 1.087411843748348
Energy: 1.2291451595880654
Energy: 1.099090028522202
Energy: 1.229145159590867
Energy: 1.099090028521771
Energy: 1.2291451595900766
Energy: 1.099090028522202
Energy: 1.110171053538216
Energy: 1.4506714607595181
Energy: 1.110171053534265
Energy: 1.4506714607595181
Energy: 1.1101710535358456
Energy: 1.4506714607603082
Energy: 1.1432973825420816
Energy: 1.119396978626716
Energy: 1.1432973825436623
Energy: 1.1193969786263567
Energy: 1.1432973825456736
Energy: 1.1193969786247764
Energy: 1.0723921418145674
Energy: 1.120303421090474
Energy: 1.0723921418126279
Energy: 1.1203034210893246
Energy: 1.0723921418142084
Energy: 1.1203034210936351
Energy: 1.1686239305894188
Energy: 1.388868077106115
Energy: 1.1686239305890596
Energy: 1.3888680771056838
Energy: 1.168623930590209
Energy: 1.388868077106115
Energy: 1.0421372990910864
Energy: 1.229352871173075
Energy: 1.042137299092667
Energy: 1.229352871173075
Energy: 1.0421372990918767
Energy: 1.229352871173075

minimum gb energy = 1.0322019729950471 eV
minimum distance =  2.32909622347612 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.2372414435739896
Energy: 1.146009745203624
Energy: 1.2372414435739896
Energy: 1.146009745203624
Energy: 1.2372414435739896
Energy: 1.146009745203624
Energy: 1.2058231989405679
Energy: 1.117836612981403
Energy: 1.2058231989405679
Energy: 1.1178366129787622
Energy: 1.2058231989405679
Energy: 1.1178366129787622
Energy: 1.5033188656847296
Energy: 1.3670714128273518
Energy: 1.5033188656847296
Energy: 1.3670714128299923
Energy: 1.7193634800446704
Energy: 1.3670714128299923
Energy: 1.2061923142167688
Energy: 1.1192655807192529
Energy: 1.2061923142167688
Energy: 1.1192655807192529
Energy: 1.2061923142167688
Energy: 1.1192655807192529
Energy: 1.237241443571349
Energy: 1.1460097452009832
Energy: 1.237241443571349
Energy: 1.1460097452009832
Energy: 1.237241443571349
Energy: 1.1460097452009832
Energy: 1.2058231989405679
Energy: 1.1178366129787622
Energy: 1.2058231989432084
Energy: 1.1178366129787622
Energy: 1.2058231989405679
Energy: 1.1178366129787622
Energy: 1.1214265889209116
Energy: 1.3670714128273518
Energy: 1.1214265889209116
Energy: 1.3670714128273518
Energy: 1.121426588918271
Energy: 1.3670714128273518

minimum gb energy = 1.1178366129787622 eV
minimum distance =  2.33923414204457 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.6763574334401437
Energy: 1.3187091540506366
Energy: 1.6763574334401437
Energy: 1.3187091540506366
Energy: 1.6763574334401437
Energy: 1.3187091540506366
Energy: 1.3537740118207178
Energy: 1.2589963398579591
Energy: 1.3537740118207178
Energy: 1.2589963398579591
Energy: 1.3537740118243113
Energy: 1.2589963398579591
Energy: 1.3114631691195398
Energy: 1.375679681225514
Energy: 1.3114631691195398
Energy: 1.375679681225514
Energy: 1.3114631691195398
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Energy: 1.3372479375331747
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Energy: 1.372194480383581
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Energy: 1.3720831404279927
Energy: 1.417822090605039
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Energy: 1.4178221323608082
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Energy: 1.2934013769372217
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Energy: 1.2934013769372217
Energy: 1.539155877079119
Energy: 1.2934013769372217
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Energy: 1.5512152574729254
Energy: 1.2277404493221322
Energy: 1.5512152574693971
Energy: 1.2277404493185387
Energy: 1.5512152574729254
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Energy: 1.269456834172573
Energy: 1.4407077380987234
Energy: 1.2694568341689794
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Energy: 1.2694568341689794
Energy: 1.4407077380987234
Energy: 1.5093907389597283
Energy: 1.2596493824783621
Energy: 1.5093907389632564
Energy: 1.2596493824783621
Energy: 1.5093907389632564
Energy: 1.2596493824783621
Energy: 1.3749297367738684
Energy: 1.3816340667703915
Energy: 1.374929736770275
Energy: 1.381634066773985
Energy: 1.3749297367738684
Energy: 1.3816340667596112
Energy: 1.5090468794715848
Energy: 1.2700368274039642
Energy: 1.5090468794715848
Energy: 1.2700368274039642
Energy: 1.5090468794715848
Energy: 1.2700368274039642
Energy: 1.317444395638737
Energy: 1.3352064283521718
Energy: 1.317444395638737
Energy: 1.3352064283521718
Energy: 1.317444395638737
Energy: 1.3352064283521718
Energy: 1.3699102248106672
Energy: 1.2764354414862848
Energy: 1.3699102248106672
Energy: 1.2764354414862848
Energy: 1.3699102248106672
Energy: 1.2764354414862848
Energy: 1.2952877140610763
Energy: 1.4589513418936542
Energy: 1.2952877140574828
Energy: 1.4589513418972475
Energy: 1.2952877140574828
Energy: 1.4589513418972475
Energy: 1.384900550053101
Energy: 1.4049564136790864
Energy: 1.384900550053101
Energy: 1.4049564136790864
Energy: 1.3849005500566944
Energy: 1.4049564136790864
Energy: 1.297944178252775
Energy: 1.3840551890079076
Energy: 1.2979441782563688
Energy: 1.3840551890079076
Energy: 1.2979441782563688
Energy: 1.3840551890079076

minimum gb energy = 1.2277404493185387 eV
minimum distance =  2.27670870351329 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.4062336291068471
Energy: 1.346512033484853
Energy: 1.3383219664168886
Energy: 1.346512033482387
Energy: 1.4062336291127655
Energy: 1.3465120334892922
Energy: 1.2825187086510592
Energy: 1.4124340921697456
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Energy: 1.2825187086545116
Energy: 1.412434092173691
Energy: 1.5279983974467284
Energy: 1.2079411968706313
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Energy: 1.4368872154995695
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Energy: 1.2872321258608135
Energy: 1.3116920138026338
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Energy: 1.4208775159752502
Energy: 1.5280767105657995
Energy: 1.4208775159757434
Energy: 1.5280767105672795
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Energy: 1.6160825711760518
Energy: 1.2062458555924462
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Energy: 1.2062458556042832
Energy: 1.616082571181477
Energy: 1.2331117865150125
Energy: 1.2935802171316375
Energy: 1.233111786516492
Energy: 1.2935802171331172
Energy: 1.233111786512053
Energy: 1.2935802171331172
Energy: 1.3489137572355703
Energy: 1.2065488821727441
Energy: 1.3489137572350773
Energy: 1.2065488821663324
Energy: 1.3489137572400094
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Energy: 1.4132068153732014
Energy: 1.2786768624960498
Energy: 1.4131402543843532
Energy: 1.2786768624995022
Energy: 1.4132068153702424
Energy: 1.2786768624995022
Energy: 1.4180633036427575
Energy: 1.2144992930909309
Energy: 1.4180633036486763
Energy: 1.2144992930924106
Energy: 1.4180633036457169
Energy: 1.2144992930919172
Energy: 1.4457656279152817
Energy: 1.423158631299625
Energy: 1.4457656279216935
Energy: 1.423158631295186
Energy: 1.4457656279271187
Energy: 1.4231586312937066
Energy: 1.2108520064477022
Energy: 1.311647428168725
Energy: 1.2108520064452362
Energy: 1.3116474281716843
Energy: 1.2108520064477022
Energy: 1.3116474281716843
Energy: 1.2052769657149507
Energy: 1.2632687554117237
Energy: 1.2052769657149507
Energy: 1.2632687554082713
Energy: 1.2052769657149507
Energy: 1.2632687554077782
Energy: 1.20779924442408
Energy: 1.1789449241177294
Energy: 1.2077992444279808
Energy: 1.1789449241182226
Energy: 1.2077992444235868
Energy: 1.1789449241177294
Energy: 1.4448022789550208
Energy: 1.7455805119144272
Energy: 1.4447263701235267
Energy: 1.7455805119203456
Energy: 1.4448022789495956
Energy: 1.745580511919359
Energy: 1.4920782563852766
Energy: 1.4377211604494324
Energy: 1.4920782563877426
Energy: 1.4377211604494324
Energy: 1.4920782563916883
Energy: 1.43772116044598
Energy: 1.4130321531795218
Energy: 1.23602964813494
Energy: 1.4130321531805081
Energy: 1.2360296481344468
Energy: 1.413032153175576
Energy: 1.2360296481334605
Energy: 1.249187957040351
Energy: 1.2049551741951132
Energy: 1.2491879570428168
Energy: 1.2049551741951132
Energy: 1.2491879570413373
Energy: 1.2049551741951132

minimum gb energy = 1.1789449241177294 eV
minimum distance =  2.36668627058943 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.5668666289891626
Energy: 1.2819910911021262
Energy: 1.56686662899098
Energy: 1.2819910911021262
Energy: 1.5668666289897684
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Energy: 1.3503616196653623
Energy: 1.2240220934543928
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Energy: 1.3503616196647565
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Energy: 1.3434016935118411
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Energy: 1.3742331721123386
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Energy: 1.384496312919864
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Energy: 1.3002552132805132
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Energy: 1.4202086249260213
Energy: 1.2242281294657142
Energy: 1.420208624926627
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Energy: 1.4202086249254153
Energy: 1.2242281294657142
Energy: 1.4934271080034822
Energy: 1.2932187768023409
Energy: 1.4934271080028763
Energy: 1.2932187768023409
Energy: 1.4934271080034822
Energy: 1.2932187768029466
Energy: 1.4474489761190574
Energy: 1.2577628564880117
Energy: 1.4474489761190574
Energy: 1.2577628564880117
Energy: 1.4474489761190574
Energy: 1.2577628564880117
Energy: 1.4204401246066665
Energy: 1.3764832946308236
Energy: 1.4204401246066665
Energy: 1.3764832946320351
Energy: 1.4204401246060605
Energy: 1.3764832946314294
Energy: 1.2996673133325019
Energy: 1.3267562105264372
Energy: 1.2996673133331076
Energy: 1.3267562105270432
Energy: 1.2996673133337135
Energy: 1.3267562105270432
Energy: 1.4856489748639712
Energy: 1.3477682124156207
Energy: 1.4856489748639712
Energy: 1.3477682124156207
Energy: 1.4856489748639712
Energy: 1.3477682124156207
Energy: 1.1951866471893333
Energy: 1.406540264511002
Energy: 1.1951866471893333
Energy: 1.406540264511002
Energy: 1.1951866471893333
Energy: 1.406540264511002
Energy: 1.4102777950519725
Energy: 1.5370118706425764
Energy: 1.4102777950513665
Energy: 1.537011870641365
Energy: 1.4102777950507608
Energy: 1.5370118706431821
Energy: 1.273966240451391
Energy: 1.268647996317945
Energy: 1.273966240451391
Energy: 1.268647996317945
Energy: 1.273966240451391
Energy: 1.2686479963167332
Energy: 1.5054612193139667
Energy: 1.332966927204952
Energy: 1.5054612193139667
Energy: 1.332966927204952
Energy: 1.5054612193145727
Energy: 1.332966927204952
Energy: 1.2657396354097898
Energy: 1.4223433786366793
Energy: 1.2657396354097898
Energy: 1.4223433786366793
Energy: 1.2657396354091839
Energy: 1.4223433786361008
Energy: 1.4567548573449984
Energy: 1.3161387908816862
Energy: 1.4567548573443925
Energy: 1.3161387908816862
Energy: 1.4567548573443925
Energy: 1.3161387908816862
Energy: 1.274141408185521
Energy: 1.4042239525671785
Energy: 1.274141408185521
Energy: 1.4042239525671785
Energy: 1.274141408185521
Energy: 1.4042239525671785
Energy: 1.3540436852751148
Energy: 1.3593738079818953
Energy: 1.3540436852751148
Energy: 1.3593738079818953
Energy: 1.3540436852757203
Energy: 1.3593738079812898
Energy: 1.3848966042603845
Energy: 1.3345122709881572
Energy: 1.3848966042603845
Energy: 1.3345122709881572
Energy: 1.3848966042609905
Energy: 1.3345122709881572

minimum gb energy = 1.1948601225124533 eV
minimum distance =  2.33186239072495 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.3906492503247874
Energy: 1.1875453851249744
Energy: 1.3906492503224344
Energy: 1.18754538512419
Energy: 1.390649250324003
Energy: 1.1875453851249744
Energy: 1.2812243566682013
Energy: 1.1373362746259263
Energy: 1.2812243566689856
Energy: 1.1373362746267108
Energy: 1.2812243566682013
Energy: 1.1373362746274953
Energy: 1.326387377934653
Energy: 1.4460287164301548
Energy: 1.3263873779330844
Energy: 1.4460287164301548
Energy: 1.326387377934653
Energy: 1.4460287164293706
Energy: 1.657301472143488
Energy: 1.3219649430102556
Energy: 1.6573014721419193
Energy: 1.32196494301104
Energy: 1.6573014721427037
Energy: 1.3219649430118245
Energy: 1.3251604528557746
Energy: 1.3208826767043869
Energy: 1.3251604528581276
Energy: 1.320882676702818
Energy: 1.3251604528549898
Energy: 1.3208826766996806
Energy: 1.3305143805523192
Energy: 1.2995023251361428
Energy: 1.3305143805523192
Energy: 1.2995023251361428
Energy: 1.330514380551535
Energy: 1.2995023251361428
Energy: 1.3402160981174085
Energy: 1.4006528477388853
Energy: 1.34021609811584
Energy: 1.4006528477388853
Energy: 1.340216098118193
Energy: 1.4006528477388853
Energy: 1.3913337865743547
Energy: 1.1892836789607797
Energy: 1.3913337865767077
Energy: 1.1892836789615642
Energy: 1.3913337865814142
Energy: 1.1892836789607797
Energy: 1.2913267883978952
Energy: 1.1375358713867672
Energy: 1.2913267883947577
Energy: 1.1375358713851984
Energy: 1.2913267883963262
Energy: 1.1375358713859827
Energy: 1.1244737927216266
Energy: 1.2996808949925565
Energy: 1.124473792720058
Energy: 1.2996808949933407
Energy: 1.1244737927216266
Energy: 1.2996808949925565
Energy: 1.3440342260398168
Energy: 1.324397392835518
Energy: 1.344034226038248
Energy: 1.324397392835518
Energy: 1.3440342260421345
Energy: 1.324397392835518
Energy: 1.2940216840438064
Energy: 1.3877034436390392
Energy: 1.2940216840571412
Energy: 1.3877034436390392
Energy: 1.2940216840445908
Energy: 1.3877034436382547
Energy: 1.3271841313582213
Energy: 1.1368662873487128
Energy: 1.3271841313566526
Energy: 1.1368662873479283
Energy: 1.3271841313574368
Energy: 1.1368662873494972
Energy: 1.4419735164529857
Energy: 1.1485707675828996
Energy: 1.4419735164529857
Energy: 1.1485707675828996
Energy: 1.4419735164529857
Energy: 1.1485707675828996
Energy: 1.285506993968217
Energy: 1.1423293448129066
Energy: 1.2855069939690014
Energy: 1.142329344811338
Energy: 1.2855069939729233
Energy: 1.1423293448105536
Energy: 1.2805245702586598
Energy: 1.2558298334422946
Energy: 1.280524570259444
Energy: 1.2558298334422946
Energy: 1.2805245702586598
Energy: 1.2558298334422946
Energy: 1.1220777117624805
Energy: 1.296205665690408
Energy: 1.1220777117632648
Energy: 1.2962056656919765
Energy: 1.122077711761696
Energy: 1.2962056656911924
Energy: 1.3321472923730602
Energy: 1.3310886854218662
Energy: 1.3321472923754132
Energy: 1.3310886854218662
Energy: 1.3321472923746287
Energy: 1.3310886854218662
Energy: 1.1218769263154207
Energy: 1.293416858628093
Energy: 1.1218769263162052
Energy: 1.293416858628093
Energy: 1.1218769263169894
Energy: 1.2934168586273085
Energy: 1.2804405490459247
Energy: 1.2558568283387768
Energy: 1.280440549044356
Energy: 1.2558568283419143
Energy: 1.2804405490451403
Energy: 1.2558568283411298
Energy: 1.285377754151881
Energy: 1.188524942471668
Energy: 1.2853777541510967
Energy: 1.188524942471668
Energy: 1.2853777541542342
Energy: 1.1885249424779432
Energy: 1.441972602101389
Energy: 1.2072847110736413
Energy: 1.4419726021006047
Energy: 1.20728471107521
Energy: 1.441972602101389
Energy: 1.2072847110744256
Energy: 1.3272406125568958
Energy: 1.1377160508359738
Energy: 1.32724061255768
Energy: 1.1377160508367585
Energy: 1.32724061255768
Energy: 1.1377160508359738
Energy: 1.2932665387663154
Energy: 1.3878691654734605
Energy: 1.2932665387663154
Energy: 1.387869165474245
Energy: 1.2932665387663154
Energy: 1.387869165474245

minimum gb energy = 1.1218769263154207 eV
minimum distance =  2.34865510820891 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.3242609055990973
Energy: 1.1665685450918204
Energy: 1.3242609056002066
Energy: 1.1665685450918204
Energy: 1.3242609056002066
Energy: 1.1665685450918204
Energy: 1.1585931861118164
Energy: 1.1022560702444029
Energy: 1.1585931861118164
Energy: 1.1022560702432935
Energy: 1.1585931861118164
Energy: 1.102256070245512
Energy: 1.2720743804266277
Energy: 1.3159995895429062
Energy: 1.2720743804266277
Energy: 1.3159995895417966
Energy: 1.2720743804266277
Energy: 1.3159995895417966
Energy: 1.1798133271480673
Energy: 1.2871818698190645
Energy: 1.1798133271458486
Energy: 1.2871818698190645
Energy: 1.1798133271480673
Energy: 1.2871818698190645
Energy: 1.2822016041052189
Energy: 1.2186335160699289
Energy: 1.2822016041063282
Energy: 1.218633516071038
Energy: 1.2822016041052189
Energy: 1.2186335160699289
Energy: 1.1687423910014034
Energy: 1.2766945915589554
Energy: 1.1687423910014034
Energy: 1.2766945915589554
Energy: 1.1687423910014034
Energy: 1.2766945915589554
Energy: 1.2133458386474725
Energy: 1.1077458274659802
Energy: 1.213345838583133
Energy: 1.1077458274659802
Energy: 1.213345838583133
Energy: 1.1077458274670895
Energy: 1.1794635550512487
Energy: 1.3229740524010987
Energy: 1.1794635550479209
Energy: 1.3229740524022078
Energy: 1.1794635550512487
Energy: 1.3229740523999893
Energy: 1.2390083935785625
Energy: 1.1022937697015405
Energy: 1.2390083935796719
Energy: 1.1022937697004311
Energy: 1.2390083935785625
Energy: 1.1022937697015405
Energy: 1.195797049110265
Energy: 1.1178630939128633
Energy: 1.1957970491113743
Energy: 1.1178630939095355
Energy: 1.1957970491113743
Energy: 1.1178630939128633
Energy: 1.173186193068785
Energy: 1.2675305951749143
Energy: 1.173186193068785
Energy: 1.2675305951760236
Energy: 1.173186193067676
Energy: 1.2675305951749143
Energy: 1.2747868680948782
Energy: 1.2497732658811322
Energy: 1.2747868680904408
Energy: 1.2497732658822418
Energy: 1.2747868680926595
Energy: 1.2497732658822418
Energy: 1.0389554721696512
Energy: 1.274917108909787
Energy: 1.038955472168542
Energy: 1.2749171089108964
Energy: 1.038955472168542
Energy: 1.2749171089108964
Energy: 1.1945609822006253
Energy: 1.2497666771990952
Energy: 1.1945609821995162
Energy: 1.2497666771990952
Energy: 1.1945609822006253
Energy: 1.2497666771990952
Energy: 1.167370612896438
Energy: 1.41945421213691
Energy: 1.167370612896438
Energy: 1.41945421213691
Energy: 1.167370612895329
Energy: 1.41945421213691
Energy: 1.1683575269354947
Energy: 1.2759859189083465
Energy: 1.168357526936604
Energy: 1.2759859189072373
Energy: 1.168357526934385
Energy: 1.2759859189072373
Energy: 1.1920404384321903
Energy: 1.2494310523649874
Energy: 1.1920404384299719
Energy: 1.2494310523649874
Energy: 1.1920404384299719
Energy: 1.2494310523649874

minimum gb energy = 1.038955472168542 eV
minimum distance =  2.30916727456349 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.1944709086385488
Energy: 1.0559135180986166
Energy: 1.1944709086376921
Energy: 1.055913518099045
Energy: 1.1944709086381207
Energy: 1.0559135180994736
Energy: 1.0934266038972855
Energy: 1.0704336059807869
Energy: 1.0934266038908598
Energy: 1.0704336059812152
Energy: 1.0934266038951437
Energy: 1.0704336059812152
Energy: 1.1905781984277934
Energy: 1.1190800332934523
Energy: 1.190578198427365
Energy: 1.1190800332934523
Energy: 1.1905781984277934
Energy: 1.119080033293024
Energy: 1.1020130929546463
Energy: 1.1069263243213798
Energy: 1.1020130929495449
Energy: 1.1423605773903494
Energy: 1.1020130929504015
Energy: 1.1069263243200949
Energy: 1.2114736970660227
Energy: 1.016489431003422
Energy: 1.2114736970681645
Energy: 1.0164894310077057
Energy: 1.2114736970694497
Energy: 1.0164894310021368
Energy: 1.1184858075749156
Energy: 1.0310479290834207
Energy: 1.1184858075749156
Energy: 1.0310479290834207
Energy: 1.1184858075749156
Energy: 1.0310479290834207
Energy: 1.0749555670022095
Energy: 1.05555634495763
Energy: 1.0749555670120623
Energy: 1.0555563449597718
Energy: 1.0749555669953557
Energy: 1.0555563449572016
Energy: 1.180962509547054
Energy: 1.3414265248820565
Energy: 1.1809625095466258
Energy: 1.341426524885055
Energy: 1.1809625095474825
Energy: 1.3414265248837698
Energy: 1.096606218841152
Energy: 1.1315735472072501
Energy: 1.0966062188428658
Energy: 1.1315735472068218
Energy: 1.0966062188424373
Energy: 1.1315735472068218
Energy: 1.0718801555070603
Energy: 0.9614411073562054
Energy: 1.0718801555074888
Energy: 0.9614411073549203
Energy: 1.0718801555074888
Energy: 0.9614411073544918
Energy: 0.9827873755239291
Energy: 1.1808365593861951
Energy: 0.9827873755217874
Energy: 1.1808365431966361
Energy: 0.9827873755205022
Energy: 1.1808364819781203
Energy: 1.1901006843202007
Energy: 1.041794149723454
Energy: 1.1901006843193436
Energy: 1.041794149722597
Energy: 1.1901006843193436
Energy: 1.041794149722597
Energy: 1.0943813009526637
Energy: 1.0453779030872592
Energy: 1.0943813009530923
Energy: 1.0453779030902581
Energy: 1.094381300953949
Energy: 1.0453779030885444
Energy: 1.0907957322347441
Energy: 1.1762311282170321
Energy: 1.0907957322364576
Energy: 1.1762311282166038
Energy: 1.0907957322356008
Energy: 1.1762311282161753
Energy: 1.171348279570835
Energy: 1.1632253895293365
Energy: 1.171348279570835
Energy: 1.1632253895276232
Energy: 1.1713482795704067
Energy: 1.16322538952848
Energy: 0.9884473970607712
Energy: 1.1155740429878727
Energy: 0.9884473970599145
Energy: 1.1155740429891576
Energy: 0.988447397061628
Energy: 1.1155740429874441
Energy: 1.0911431580333784
Energy: 1.1066906787640316
Energy: 1.0911431580338067
Energy: 1.1066906787644601
Energy: 1.0911431580346636
Energy: 1.1066906787640316
Energy: 1.1259507059997202
Energy: 1.332404062077983
Energy: 1.1259507060040042
Energy: 1.3324040620775544
Energy: 1.1259507060014338
Energy: 1.3324040620775544
Energy: 1.0824159914977476
Energy: 1.2423920773001396
Energy: 1.0824159914998894
Energy: 1.2423920773001396
Energy: 1.0824159914960343
Energy: 1.242392077299711
Energy: 1.0904387674835705
Energy: 1.0622200268465092
Energy: 1.0904387674827138
Energy: 1.0622200268469375
Energy: 1.0904387674831422
Energy: 1.0622200268460806
Energy: 1.082216184483317
Energy: 1.2424030314743832
Energy: 1.0822161844824603
Energy: 1.2424030314735264
Energy: 1.082216184483317
Energy: 1.242403031473955
Energy: 1.1260402208081934
Energy: 1.3338344325315508
Energy: 1.1260402208094786
Energy: 1.333834432531161
Energy: 1.1260402208069087
Energy: 1.3338344325303044
Energy: 1.0913497483484382
Energy: 1.1070506375199483
Energy: 1.0913497483492949
Energy: 1.10705063751952
Energy: 1.0913497483484382
Energy: 1.10705063751952
Energy: 0.9874749499063057
Energy: 1.2015351754481758
Energy: 0.9874749499054489
Energy: 1.2015351754490324
Energy: 0.9874749499054489
Energy: 1.2015351754481758
Energy: 1.1713357051800426
Energy: 1.163203217661173
Energy: 1.171335705178368
Energy: 1.1632032176594596
Energy: 1.1713357051834694
Energy: 1.1632032176607447
Energy: 1.0916480901172916
Energy: 1.1764045915498742
Energy: 1.0916480901172916
Energy: 1.1764045915503025
Energy: 1.0916480901172916
Energy: 1.1764045915503025
Energy: 1.0944798048668776
Energy: 1.0448835555462344
Energy: 1.0944798048681625
Energy: 1.044883555546663
Energy: 1.0944798048681625
Energy: 1.0448835555462344
Energy: 1.1899936019553927
Energy: 1.0421343855266165
Energy: 1.1899936019549642
Energy: 1.042134385527045
Energy: 1.1899936019545359
Energy: 1.0421343855261882
Energy: 0.982837160870485
Energy: 1.1818711848917838
Energy: 0.9828371608713417
Energy: 1.181871162690991
Energy: 0.9828371608721985
Energy: 1.1818711186858442
Energy: 1.0721648266789816
Energy: 1.1721410484486032
Energy: 1.0721648266789816
Energy: 1.1721410484477464
Energy: 1.0721648266785535
Energy: 1.172141048447318
Energy: 1.0963839225565166
Energy: 1.1318599424114784
Energy: 1.0963839225573735
Energy: 1.1318599424106217
Energy: 1.0963839225573735
Energy: 1.1318599424110498
Energy: 1.1816157440784436
Energy: 1.350466075167417
Energy: 1.1816157440793007
Energy: 1.350466075167845
Energy: 1.1816157440784436
Energy: 1.3504660751669884
Energy: 1.0739685209837395
Energy: 1.0550570211595476
Energy: 1.0739685209815977
Energy: 1.0550570211561203
Energy: 1.0739685209820262
Energy: 1.0550570211561203
Energy: 1.118124160607588
Energy: 1.067442635665497
Energy: 1.1181241606080166
Energy: 1.067442635665497
Energy: 1.1181241606093015
Energy: 1.0674426356629656
Energy: 1.2122284690113767
Energy: 1.0148227043743232
Energy: 1.2122284690100917
Energy: 1.0148227043696112
Energy: 1.2122284690096632
Energy: 1.014822704376465
Energy: 1.1061582060097426
Energy: 1.10669445558318
Energy: 1.1061582060067436
Energy: 1.106694455583608
Energy: 1.1061582060097426
Energy: 1.1066944555840366
Energy: 1.1905272177996704
Energy: 1.1190656696324963
Energy: 1.1905272178000987
Energy: 1.1190656696324963
Energy: 1.1905272178000987
Energy: 1.1190656696324963
Energy: 1.093493590147645
Energy: 1.0405164143693475
Energy: 1.0934935901489302
Energy: 1.0405164143684908
Energy: 1.0934935901493588
Energy: 1.0405164143689194
Energy: 1.1944709086381207
Energy: 1.0559135180999017
Energy: 1.1944709086389773
Energy: 1.0559135180986166
Energy: 1.1944709086376921
Energy: 1.0559135180986166
Energy: 1.093426603902426
Energy: 1.0297755343459418
Energy: 1.0934266038972855
Energy: 1.0297755343459418
Energy: 1.0934266039011409
Energy: 1.0297755343467982
Energy: 1.1905781984222243
Energy: 1.119080033296412
Energy: 1.1905781984226527
Energy: 1.1190800332959836
Energy: 1.1905781984230812
Energy: 1.1190800332959836
Energy: 1.1020130929516478
Energy: 1.1602162028219005
Energy: 1.1020130929486882
Energy: 1.1602162028214722
Energy: 1.10201309295083
Energy: 1.1602162028159033
Energy: 1.2114736970634525
Energy: 1.0164894310051356
Energy: 1.2114736970643092
Energy: 1.016489431004707
Energy: 1.2114736970647375
Energy: 1.0164894310055639

minimum gb energy = 0.9614411073544918 eV
minimum distance =  2.33008841911006 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 1.0988886231749384
Energy: 0.9816341204532214
Energy: 1.0988886231749384
Energy: 0.9816341204532214
Energy: 1.0988886231756358
Energy: 0.9816341204532214
Energy: 1.1145466388655099
Energy: 1.1055587067992183
Energy: 1.1145466388662075
Energy: 1.1055587067999157
Energy: 1.1145466388655099
Energy: 1.1055587067992183
Energy: 1.1652942843621013
Energy: 1.1046225675962285
Energy: 1.165294284365589
Energy: 1.1046225675962285
Energy: 1.1652942843711689
Energy: 1.104622567595531
Energy: 1.033518557598762
Energy: 1.0714045749052248
Energy: 1.033518557598762
Energy: 1.0714045749045273
Energy: 1.0335185575959718
Energy: 1.0714045749052248
Energy: 1.1099293241688233
Energy: 0.9528907292623704
Energy: 1.1099293241681258
Energy: 0.9528907292644627
Energy: 1.1099293241688233
Energy: 0.9528907292644627
Energy: 1.0640128632550103
Energy: 0.9640153534656988
Energy: 1.0640128632584975
Energy: 0.9640153534656988
Energy: 1.0640128632557078
Energy: 0.9640153534656988
Energy: 1.217992668328567
Energy: 1.026198665831041
Energy: 1.2179926683264743
Energy: 1.0261986658317384
Energy: 1.2179926683278695
Energy: 1.0261986658289484
Energy: 1.2328217837203306
Energy: 1.253274663657853
Energy: 1.232821783721028
Energy: 1.2532746636585503
Energy: 1.2328217837224231
Energy: 1.2532746636585503
Energy: 0.9689297368502225
Energy: 0.9662492231605262
Energy: 0.9689297368516175
Energy: 0.9662492231605262
Energy: 0.9689297368509201
Energy: 0.9662492231605262
Energy: 0.9897346633462847
Energy: 0.9848982222654302
Energy: 0.9897346633476796
Energy: 0.9848982222647327
Energy: 0.9897346633434946
Energy: 0.9848982222647327
Energy: 1.2180244374787554
Energy: 1.2419327343549214
Energy: 1.2180244374794529
Energy: 1.2419327343563165
Energy: 1.2180244374787554
Energy: 1.241932734355619
Energy: 1.0135001660391982
Energy: 1.0219458879442975
Energy: 1.0135001660378034
Energy: 1.0219458879449952
Energy: 1.0135001660385008
Energy: 1.0219458879436
Energy: 0.9863499331665939
Energy: 1.1005021370499775
Energy: 0.9863499331638041
Energy: 1.100502137050675
Energy: 0.9863499331651989
Energy: 1.1005021370499775
Energy: 0.9853351621528764
Energy: 1.149461673832464
Energy: 0.985335162152179
Energy: 1.149461673832464
Energy: 0.985335162153574
Energy: 1.1494616738317662
Energy: 1.0995298270416414
Energy: 0.9777298160633962
Energy: 1.0995298270402465
Energy: 0.9777298160626986
Energy: 1.099529827040944
Energy: 0.9777298160661859
Energy: 1.1336368880697403
Energy: 1.1305036530477177
Energy: 1.1336368880704377
Energy: 1.13050365304702
Energy: 1.1336368880704377
Energy: 1.1305036530477177
Energy: 1.1501046835870212
Energy: 1.116710423018657
Energy: 1.1501046835842312
Energy: 1.1167104230193547
Energy: 1.1501046835856261
Energy: 1.116710423018657
Energy: 1.1910773848705485
Energy: 1.0837417043762991
Energy: 1.191077384868456
Energy: 1.0837417043769966
Energy: 1.191077384868456
Energy: 1.0837417043769966
Energy: 1.100847518296196
Energy: 1.1720884128025342
Energy: 1.1008475182968935
Energy: 1.1720884128025342
Energy: 1.1008475182954984
Energy: 1.1720884128025342
Energy: 0.981611368152241
Energy: 1.0664700376908869
Energy: 0.9816113681501487
Energy: 1.0664700376915845
Energy: 0.9816113681543335
Energy: 1.0664700376908869
Energy: 1.0394030352441
Energy: 1.2482621243125875
Energy: 1.0394030352441
Energy: 1.2482621243090999
Energy: 1.0394030352454948
Energy: 1.2482621243111924
Energy: 0.917888868538236
Energy: 1.1768628772224414
Energy: 0.9178888685389335
Energy: 1.1768628772210463
Energy: 0.9178888685410258
Energy: 1.1768628772210463
Energy: 1.012002202398147
Energy: 1.0104429944970514
Energy: 1.0120022023960549
Energy: 1.0104429944970514
Energy: 1.012002202396752
Energy: 1.0104429944970514
Energy: 0.9975272932688946
Energy: 1.387265130107989
Energy: 0.997527293266802
Energy: 1.3872651301072916
Energy: 0.9975272932674996
Energy: 1.3872651301072916
Energy: 1.089829116828728
Energy: 1.2617233767717313
Energy: 1.0898291168294256
Energy: 1.2617233767717313
Energy: 1.0898291168280305
Energy: 1.261723376772429
Energy: 0.9826929517020492
Energy: 1.009841128702447
Energy: 0.9826929517027466
Energy: 1.009841128702447
Energy: 0.9826929517013516
Energy: 1.009841128702447
Energy: 0.9142227127789794
Energy: 1.1719451913893792
Energy: 0.9142227127796768
Energy: 1.1719451913893792
Energy: 0.9142227127775843
Energy: 1.1719451913893792

minimum gb energy = 0.9142227127775843 eV
minimum distance =  2.29754175147571 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 1.2003138526126937
Energy: 0.8997583247617353
Energy: 1.2003138526126937
Energy: 0.8997583247622436
Energy: 1.2003138526126937
Energy: 0.8997583247622436
Energy: 0.9825627703684299
Energy: 1.0192209046993157
Energy: 0.9825627703669053
Energy: 1.0192209046993157
Energy: 0.9825627703679217
Energy: 1.0192209046993157
Energy: 1.0246665758853493
Energy: 1.0190073862905569
Energy: 1.024666575884333
Energy: 1.0190073862915732
Energy: 1.0246665758853493
Energy: 1.019007386291065
Energy: 1.1410369560136113
Energy: 0.93692177433996
Energy: 1.1410369560141194
Energy: 0.93692177433996
Energy: 1.1410369560146274
Energy: 0.936921774339452
Energy: 0.9739020568459846
Energy: 0.9686951651926284
Energy: 0.97390205684446
Energy: 0.9686951651921202
Energy: 0.9739020568454764
Energy: 0.9686951651926284
Energy: 0.9388029272205264
Energy: 0.8847859762880428
Energy: 0.9388029272205264
Energy: 0.884785976288551
Energy: 0.9388029272210346
Energy: 0.8847859762875346
Energy: 1.0691421156696235
Energy: 0.9101962763507023
Energy: 1.0691421156696235
Energy: 0.9101962763507023
Energy: 1.0691421156686072
Energy: 0.9101962763532433
Energy: 1.1814902203754203
Energy: 1.0544491999217747
Energy: 1.1814902203754203
Energy: 1.0544491999217747
Energy: 1.181490220374404
Energy: 1.0544491999217747
Energy: 0.8764971535575117
Energy: 0.8719427786889822
Energy: 0.8764971535580199
Energy: 0.8719427786905067
Energy: 0.876497153560561
Energy: 0.871942778691015
Energy: 0.9834805242812837
Energy: 0.8632361440551667
Energy: 0.9834805242812837
Energy: 0.8632361440556748
Energy: 0.9834805242802673
Energy: 0.8632361440561831
Energy: 1.0690210748424114
Energy: 1.0640942771828448
Energy: 1.0690210748424114
Energy: 1.0640942771828448
Energy: 1.0690210748424114
Energy: 1.0640942771828448
Energy: 0.83296347244663
Energy: 0.9574762888282239
Energy: 0.8329634724451055
Energy: 0.9574762888287319
Energy: 0.832963472446122
Energy: 0.9574762888287319
Energy: 0.9830162169214514
Energy: 0.8204435754326446
Energy: 0.9830162169214514
Energy: 0.8204435754301036
Energy: 0.9830162169214514
Energy: 0.8204435754321365
Energy: 1.0795241926393375
Energy: 0.9568567295125399
Energy: 1.0795241926388295
Energy: 0.9568567295125399
Energy: 1.0795241926403538
Energy: 0.9568567295125399
Energy: 0.8628039294189479
Energy: 0.9585417795021011
Energy: 0.8628039294189479
Energy: 0.9585417795021011
Energy: 0.8628039294184398
Energy: 0.9585417795021011
Energy: 1.0041813567770008
Energy: 0.9420118389618408
Energy: 1.004181356777509
Energy: 0.9420118389613326
Energy: 1.0041813567785254
Energy: 0.9420118389608244
Energy: 1.0906631678295355
Energy: 1.0534297105325887
Energy: 1.0906631678290273
Energy: 1.0534297105325887
Energy: 1.0906631678295355
Energy: 1.0534297105325887
Energy: 0.8905700440772287
Energy: 0.9567578724800356
Energy: 0.8905700440757042
Energy: 0.9567578724800356
Energy: 0.8905700440762124
Energy: 0.9567578724800356
Energy: 0.9673499390305434
Energy: 0.9672634396751169
Energy: 0.9673499390305434
Energy: 0.9672634396751169
Energy: 0.9673499390310516
Energy: 0.9672634396751169
Energy: 1.1194439137391663
Energy: 0.95559684413559
Energy: 1.1194439137401826
Energy: 0.95559684413559
Energy: 1.1194439137396743
Energy: 0.9555968441360982
Energy: 0.9648943000300242
Energy: 0.9124641856606899
Energy: 0.964894300032565
Energy: 0.9124641856637391
Energy: 0.9648943000295621
Energy: 0.9124641856611981
Energy: 1.0314750315451342
Energy: 0.9912453322351107
Energy: 1.0314750315441177
Energy: 0.9912453322351107
Energy: 1.031475031544626
Energy: 0.991245332235619
Energy: 1.0283422327117524
Energy: 0.9720558192754828
Energy: 1.0283422327117524
Energy: 0.9720558192754828
Energy: 1.0283422327112441
Energy: 0.9720558192754828
Energy: 1.0343392244445668
Energy: 1.0315615353964345
Energy: 1.0343392244440588
Energy: 1.0315615353969427
Energy: 1.0343392244420258
Energy: 1.031561535397451
Energy: 0.968705759435526
Energy: 0.8502442878713043
Energy: 0.968705759435526
Energy: 0.8502442878718126
Energy: 0.968705759435526
Energy: 0.8502442878713043
Energy: 0.9679144430918238
Energy: 0.9343915573006266
Energy: 0.967914443089791
Energy: 0.9343915573001185
Energy: 0.9679144430913156
Energy: 0.9343915573001185
Energy: 0.8898354304206288
Energy: 1.096846489626018
Energy: 0.8898354304216453
Energy: 1.096846489626018
Energy: 0.8898354304201206
Energy: 1.096846489626526
Energy: 0.9330703973448163
Energy: 0.9477283043565371
Energy: 0.9330703973448163
Energy: 0.9477283043555208
Energy: 0.9330703973463409
Energy: 0.9477283043560291
Energy: 0.8623547198050598
Energy: 0.8812741816588165
Energy: 0.8623547198045517
Energy: 0.8812741816588165
Energy: 0.8623547198050598
Energy: 0.8812741816588165
Energy: 0.8567071294629902
Energy: 1.068919852280076
Energy: 0.8567071294619737
Energy: 1.068919852280076
Energy: 0.8567071294609574
Energy: 1.068919852280076
Energy: 0.8917145711315045
Energy: 1.1781187913855242
Energy: 0.8917145711290098
Energy: 1.1781187913855242
Energy: 0.8917145711340456
Energy: 1.178118791385016
Energy: 0.8633430745750965
Energy: 0.8460557395467405
Energy: 0.8633430745756048
Energy: 0.8460557395467405
Energy: 0.8633430745761129
Energy: 0.8460557395467405
Energy: 0.8278561685341709
Energy: 0.9511454901472769
Energy: 0.8278561685362036
Energy: 0.951145490150326
Energy: 0.8278561685341709
Energy: 0.9511454901508343
Energy: 1.0793908011158628
Energy: 1.0735366679850116
Energy: 1.0793908011153548
Energy: 1.0735366679850116
Energy: 1.0793908011158628
Energy: 1.0735366679850116
Energy: 0.8981741401383189
Energy: 0.8203322039348571
Energy: 0.8981741401367944
Energy: 0.8203322039348571
Energy: 0.8981741401393353
Energy: 0.8203322039348571
Energy: 0.7715005228936203
Energy: 0.9495396888826138
Energy: 0.7715005228951448
Energy: 0.9495396888826138
Energy: 0.7715005228946368
Energy: 0.9495396888826138

minimum gb energy = 0.7715005228936203 eV
minimum distance =  2.29293914530203 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.3850105322293064
Energy: 0.43534943546158383
Energy: 0.08263379430354448
Energy: 0.43534943546158383
Energy: 0.3850105322293064
Energy: 0.43534943546345106
Energy: 1.0804980183108281
Energy: 0.08410458574803038
Energy: 1.080498018308961
Energy: 0.08410458574803038
Energy: 1.0804980183108281
Energy: 0.08410458574803038
Energy: 0.38223973655541305
Energy: 0.08316682332146588
Energy: 0.38223973655541305
Energy: 0.08316682332146588
Energy: 0.38223973655541305
Energy: 0.08316682332146588
Energy: 0.08263379430354448
Energy: 0.43534943546345106
Energy: 0.08263379430354448
Energy: 0.43534943546345106
Energy: 0.08263379430354448
Energy: 0.43534943546345106
Energy: 1.0804980183108281
Energy: 0.08410458565471121
Energy: 1.080498018308961
Energy: 0.08410458566404737
Energy: 1.0804980183108281
Energy: 0.08410458567338353
Energy: 0.3822397365572802
Energy: 0.08316682332146588
Energy: 0.3822397365572802
Energy: 0.08316682332146588
Energy: 0.3822397365572802
Energy: 0.08316682331959865
Energy: 0.3850105322274392
Energy: 0.43534943546345106
Energy: 0.08263379430354448
Energy: 0.43534943546345106
Energy: 0.3850105322274392
Energy: 0.43534943546345106
Energy: 1.0804980183108281
Energy: 0.08410458560616317
Energy: 1.080498018308961
Energy: 0.08410458560433837
Energy: 1.0804980183108281
Energy: 0.08410458559500221
Energy: 0.3822397365591475
Energy: 0.08316682331959865
Energy: 0.3822397365591475
Energy: 0.08316682331959865
Energy: 0.3822397365591475
Energy: 0.08316682331959865
Energy: 0.08263379430354448
Energy: 0.43534943546158383
Energy: 0.08263379430354448
Energy: 0.43534943546158383
Energy: 0.08263379430354448
Energy: 0.43534943546158383

minimum gb energy = 0.08263379430354448 eV
minimum distance =  2.43946960559625 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 1.0325635930691164
Energy: 0.8641940946837161
Energy: 1.0325635930696753
Energy: 0.864194094684275
Energy: 1.0325635930691164
Energy: 0.864194094684275
Energy: 0.8621791095484175
Energy: 0.8730187266684978
Energy: 0.8621791095478587
Energy: 0.8730187266690567
Energy: 0.8621791095484175
Energy: 0.8730187266690567
Energy: 0.8907371750103174
Energy: 0.8693204032712182
Energy: 0.943735276161147
Energy: 0.8693204032707101
Energy: 0.8903899803677953
Energy: 0.8693204032712182
Energy: 0.9636336527175626
Energy: 0.9117343569887463
Energy: 0.9636336527186804
Energy: 0.9117343569887463
Energy: 0.9636336527175626
Energy: 0.9117343569887463
Energy: 0.7420643230014169
Energy: 0.8843460753249816
Energy: 0.7420643230008581
Energy: 0.8843460753255403
Energy: 0.7420643230014169
Energy: 0.8843460753255403
Energy: 0.8963397574727895
Energy: 0.8908603698266468
Energy: 0.8963397574727895
Energy: 0.8908603698266468
Energy: 0.8963397574722307
Energy: 0.8908603698266468
Energy: 0.9069207748586667
Energy: 0.9657022964924555
Energy: 0.9069207748592256
Energy: 0.9657022964924555
Energy: 0.9069207748592256
Energy: 0.9657022964924555
Energy: 0.769012113289297
Energy: 0.8847575601258596
Energy: 0.769012113289297
Energy: 0.8847575601264183
Energy: 0.7690121132881795
Energy: 0.8847575601264183
Energy: 0.9078263267063056
Energy: 0.8952236601890194
Energy: 0.9078263267063056
Energy: 0.8952236601884609
Energy: 0.9078263267063056
Energy: 0.8952236601884609
Energy: 0.8493591887258939
Energy: 0.8145002310660063
Energy: 0.8493591887258939
Energy: 0.8145002310671239
Energy: 0.849359188725335
Energy: 0.814500231066565
Energy: 0.821209521001126
Energy: 0.8842815043353469
Energy: 0.8212095210022435
Energy: 0.8842815043353469
Energy: 0.821209521001126
Energy: 0.8842815043353469
Energy: 0.9244379742321456
Energy: 0.9457936037148347
Energy: 0.9244379742321456
Energy: 0.9457936037148347
Energy: 0.9244379742332631
Energy: 0.9457936037142758
Energy: 0.8745187364572528
Energy: 0.7643782722484567
Energy: 0.8745187364578115
Energy: 0.7643782722484567
Energy: 0.8745187364583704
Energy: 0.7643782722484567
Energy: 0.8477585306240553
Energy: 0.9245939221682403
Energy: 0.8477585306257315
Energy: 0.9245939221676814
Energy: 0.8477585306240553
Energy: 0.9245939221676814
Energy: 0.8849583840214804
Energy: 0.9151850084920579
Energy: 0.8849583840220393
Energy: 0.9151850084920579
Energy: 0.884958384022598
Energy: 0.9151850084920579
Energy: 0.8961502324326521
Energy: 0.7367206393683267
Energy: 0.8961502324320932
Energy: 0.7367206393700029
Energy: 0.8961502324326521
Energy: 0.7367206393688854
Energy: 0.8701862567620199
Energy: 0.9524568452938387
Energy: 0.8701862567620199
Energy: 0.9524568452938387
Energy: 0.8701862567620199
Energy: 0.9524568452932798
Energy: 0.8780204926022109
Energy: 0.8897913571604351
Energy: 0.8780204926022109
Energy: 0.8897913571604351
Energy: 0.8780204926022109
Energy: 0.8897913571604351
Energy: 0.8952547062477426
Energy: 0.8415466231134862
Energy: 0.8952547062483013
Energy: 0.841546623111251
Energy: 0.8952547062483013
Energy: 0.8415466231123685
Energy: 0.8652582595774536
Energy: 1.0114965585941427
Energy: 0.8652582595780123
Energy: 1.0114965585947013
Energy: 0.8652582595780123
Energy: 1.0114965585935838
Energy: 0.9313209342556729
Energy: 0.8654921602017099
Energy: 0.9313209342551142
Energy: 0.8654921602011512
Energy: 0.9313209342551142
Energy: 0.8654921602017099
Energy: 0.9171663705281968
Energy: 0.8900369858623035
Energy: 0.917166370527638
Energy: 0.8900369858617447
Energy: 0.9171663705304319
Energy: 0.8900369858617447
Energy: 0.9044527835905481
Energy: 0.9818370066517343
Energy: 0.9044527835905481
Energy: 0.9818370066528518
Energy: 0.9044527835899895
Energy: 0.9818370066522931
Energy: 0.8897212330195757
Energy: 0.8539219639118729
Energy: 0.8897212330190171
Energy: 0.853921963911314
Energy: 0.8897212330190171
Energy: 0.8539219639118729
Energy: 0.8944683800230966
Energy: 0.8834768830974311
Energy: 0.8944683800230966
Energy: 0.8834768830974311
Energy: 0.8944683800236553
Energy: 0.8834768830974311
Energy: 0.870488418002984
Energy: 0.934574039365792
Energy: 0.8704884180035427
Energy: 0.934574039365792
Energy: 0.8704884180024252
Energy: 0.934574039365792
Energy: 1.009565248049147
Energy: 0.7901753153365239
Energy: 1.0095652480497055
Energy: 0.7901753153365239
Energy: 1.0095652480497055
Energy: 0.7901753153365239
Energy: 0.9055521150761535
Energy: 0.9030286673152788
Energy: 0.9055521150755947
Energy: 0.9030286673152788
Energy: 0.9055521150767122
Energy: 0.9030286673158375
Energy: 0.830649140313179
Energy: 0.8730274133221511
Energy: 0.830649140313179
Energy: 0.8730274133227098
Energy: 0.8306491403137377
Energy: 0.8730274133227098
Energy: 1.0259975080905985
Energy: 0.8423739413112362
Energy: 1.025997508091716
Energy: 0.8423739413112362
Energy: 1.0259975080911576
Energy: 0.8423739413112362
Energy: 0.9019040000900518
Energy: 0.8969494343994289
Energy: 0.9019040000900518
Energy: 0.8969494343999878
Energy: 0.9019040000900518
Energy: 0.8969494343999878
Energy: 0.7909730567416188
Energy: 0.855211408858766
Energy: 0.79097305674106
Energy: 0.8552114088593249
Energy: 0.79097305674106
Energy: 0.855211408858766
Energy: 0.9094140836364398
Energy: 0.8629146941294704
Energy: 0.9094140836353223
Energy: 0.862914694130588
Energy: 0.9094140836364398
Energy: 0.8629146941300293

minimum gb energy = 0.7367206393683267 eV
minimum distance =  2.33461445236002 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.186056417346203
Energy: 1.0759675094512995
Energy: 1.1860564173446106
Energy: 1.0759675094505035
Energy: 1.1860564173454067
Energy: 1.0759675094512995
Energy: 1.0510857054173177
Energy: 1.0773142981878208
Energy: 1.0510857054173177
Energy: 1.0773142981878208
Energy: 1.051085705418114
Energy: 1.0773142981878208
Energy: 1.1180861199816976
Energy: 1.1494944210662978
Energy: 1.1180861199809013
Energy: 1.1494944210662978
Energy: 1.1180861199809013
Energy: 1.1494944210655016
Energy: 1.1335652704456392
Energy: 1.0634836925249742
Energy: 1.1335652704440466
Energy: 1.0634836925257705
Energy: 1.1335652704432504
Energy: 1.0634836925257705
Energy: 0.9337859536152008
Energy: 1.0315488023926114
Energy: 0.9337859536152008
Energy: 1.0315488023926114
Energy: 0.9337859536159969
Energy: 1.0315488023926114
Energy: 1.1154147881416725
Energy: 1.1040435228544947
Energy: 1.1154147881424687
Energy: 1.1040435228544947
Energy: 1.1154147881416725
Energy: 1.1040435228544947
Energy: 1.042522090512851
Energy: 1.1488561133012025
Energy: 1.042522090512851
Energy: 1.1488561133012025
Energy: 1.0425220905136472
Energy: 1.1488561133012025
Energy: 1.0467124047522147
Energy: 1.0314465805236586
Energy: 1.0467124047538072
Energy: 1.031446580522862
Energy: 1.046712404751419
Energy: 1.0314465805236586
Energy: 1.1669091754341305
Energy: 1.1609845327046904
Energy: 1.1669091754341305
Energy: 1.1609845327054866
Energy: 1.1669091754349266
Energy: 1.1609845327054866
Energy: 1.1117720192192404
Energy: 0.9626407996946895
Energy: 1.1117720192184444
Energy: 0.9626407996946895
Energy: 1.1117720192192404
Energy: 0.9626407996954857
Energy: 1.1547700400686955
Energy: 1.1098848265996784
Energy: 1.1547700400694918
Energy: 1.1098848266004746
Energy: 1.1547700400686955
Energy: 1.1098848265996784
Energy: 1.0453639402589834
Energy: 1.1006508503240195
Energy: 1.0453639402597794
Energy: 1.1006508503232233
Energy: 1.045363940257391
Energy: 1.1006508503240195
Energy: 1.1167889311331962
Energy: 1.0352547987239489
Energy: 1.1167889311339925
Energy: 1.0352547987231528
Energy: 1.1167889311331962
Energy: 1.0352547987239489
Energy: 1.0461726548348242
Energy: 1.1404312673556556
Energy: 1.046172654833232
Energy: 1.1404312673564516
Energy: 1.046172654834028
Energy: 1.1404312673556556
Energy: 1.0614570268392953
Energy: 1.049220493237364
Energy: 1.0614570268392953
Energy: 1.049220493237364
Energy: 1.0614570268400916
Energy: 1.049220493237364
Energy: 1.057597643362497
Energy: 1.0836966548506708
Energy: 1.0575976433593124
Energy: 1.0836966548506708
Energy: 1.0575976433609044
Energy: 1.0836966548506708
Energy: 1.102004788744124
Energy: 1.1283810976523148
Energy: 1.102004788744124
Energy: 1.1283810976523148
Energy: 1.1020047887433277
Energy: 1.1283810976531108
Energy: 1.0959401956418187
Energy: 1.0274354673191637
Energy: 1.0959401956418187
Energy: 1.0274354673199597
Energy: 1.0959401956402262
Energy: 1.0274354673191637
Energy: 1.1131385132532463
Energy: 1.1248005716352856
Energy: 1.1131385132532463
Energy: 1.1248005716352856
Energy: 1.1131385132540426
Energy: 1.1248005716352856
Energy: 1.1987005407066842
Energy: 1.1426016127012135
Energy: 1.1987005407066842
Energy: 1.1426016127012135
Energy: 1.1987005407066842
Energy: 1.1426016127012135
Energy: 1.1442645875426551
Energy: 1.03937691369342
Energy: 1.1442645875426551
Energy: 1.0393769136942161
Energy: 1.1442645875418591
Energy: 1.0393769136942161
Energy: 1.1392772092297
Energy: 1.1733657225753396
Energy: 1.1392772092289039
Energy: 1.1733657225753396
Energy: 1.1392772092297
Energy: 1.173365722574543
Energy: 0.997643541188131
Energy: 1.1636758150465938
Energy: 0.9976435411889271
Energy: 1.1636758150465938
Energy: 0.9976435411889271
Energy: 1.1636758150465938

minimum gb energy = 0.9337859536152008 eV
minimum distance =  2.32630578052134 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.3050071702962651
Energy: 1.150774249595507
Energy: 1.3050071702957602
Energy: 1.1507742495950017
Energy: 1.3050071702972754
Energy: 1.150774249595507
Energy: 1.1700915340938187
Energy: 1.2009185168371526
Energy: 1.1700915340943236
Energy: 1.200918516835132
Energy: 1.1700915340948288
Energy: 1.2009185168371526
Energy: 1.2493721324340956
Energy: 1.2480604625841385
Energy: 1.2493721324335905
Energy: 1.2480604625846436
Energy: 1.2493721324346008
Energy: 1.2480604625846436
Energy: 1.2498038647918583
Energy: 1.170451450440779
Energy: 1.249803864791353
Energy: 1.170451450440779
Energy: 1.2498038647918583
Energy: 1.170451450440779
Energy: 1.1736887140834096
Energy: 1.1938493471888492
Energy: 1.1736887140839145
Energy: 1.1938493471888492
Energy: 1.1736887140839145
Energy: 1.1938493471893543
Energy: 1.3344602057389785
Energy: 1.2382100316542544
Energy: 1.3344602057384733
Energy: 1.2879167478278963
Energy: 1.3344602057384733
Energy: 1.2750133227450366
Energy: 1.167082225213528
Energy: 1.1223889187112412
Energy: 1.1670822252140332
Energy: 1.1223889187112412
Energy: 1.1670822252125177
Energy: 1.1223889187112412
Energy: 1.2508417954990456
Energy: 1.240011921232319
Energy: 1.2508417954990456
Energy: 1.240011921232824
Energy: 1.2508417954990456
Energy: 1.240011921232824
Energy: 1.2291971793430563
Energy: 1.2566436193962984
Energy: 1.2291971793430563
Energy: 1.2566436193962984
Energy: 1.2291971793435612
Energy: 1.2566436193957935
Energy: 1.3391151300363842
Energy: 1.1895063519950038
Energy: 1.339115130035374
Energy: 1.1642079922511692
Energy: 1.3391151300363842
Energy: 1.183364904583375
Energy: 1.2890245738551993
Energy: 1.2328673432234627
Energy: 1.2890245738541892
Energy: 1.2328673432234627
Energy: 1.2890245738541892
Energy: 1.232867343223968
Energy: 1.1693416473223206
Energy: 1.172878019517434
Energy: 1.1693416473218157
Energy: 1.1728780195179391
Energy: 1.169341647322826
Energy: 1.1728780195179391
Energy: 1.2937561086435572
Energy: 1.2001492898698292
Energy: 1.2937561086425466
Energy: 1.2001492898698292
Energy: 1.2937561086435572
Energy: 1.2001492898698292
Energy: 1.1761850587751943
Energy: 1.2342011398142598
Energy: 1.1761850587772147
Energy: 1.234201139813755
Energy: 1.1761850587756995
Energy: 1.2342011398142598
Energy: 1.2134960543899296
Energy: 1.1938027491329424
Energy: 1.2134960543894244
Energy: 1.1938027491324374
Energy: 1.2134960543904347
Energy: 1.1938027491329424
Energy: 1.2494935675581813
Energy: 1.256993630746775
Energy: 1.2494935675571712
Energy: 1.25699363074526
Energy: 1.2494935675576764
Energy: 1.2569936307462701
Energy: 1.0742496995953728
Energy: 1.266902562333023
Energy: 1.0742496995953728
Energy: 1.266902562333023
Energy: 1.0742496995903217
Energy: 1.266902562333023
Energy: 1.2845153754574155
Energy: 1.318300947591607
Energy: 1.2845153754574155
Energy: 1.318300947591607
Energy: 1.2845153754569105
Energy: 1.318300947591607
Energy: 1.1669471624371597
Energy: 1.2734415029077486
Energy: 1.1669471624381698
Energy: 1.2734415029077486
Energy: 1.1669471624366545
Energy: 1.2734415029082538
Energy: 1.3111856234684054
Energy: 1.2504342650805633
Energy: 1.3111856234694155
Energy: 1.2504342650805633
Energy: 1.3111856234689105
Energy: 1.2504342650805633
Energy: 1.246775915790589
Energy: 1.2561002472553633
Energy: 1.246775915791094
Energy: 1.2561002472553633
Energy: 1.246775915789579
Energy: 1.2561002472553633
Energy: 1.2096171974780456
Energy: 1.1470668845218042
Energy: 1.2096171974780456
Energy: 1.1470668845218042
Energy: 1.2096171974790557
Energy: 1.1470668845223093
Energy: 1.2193975570347972
Energy: 1.2324311005042137
Energy: 1.219397557034292
Energy: 1.2324311005042137
Energy: 1.219397557034292
Energy: 1.2324311005042137
Energy: 1.3181177592075706
Energy: 1.173829570965483
Energy: 1.3181177592075706
Energy: 1.1738295709659878
Energy: 1.3181177592080755
Energy: 1.173829570965483
Energy: 1.1665759964998914
Energy: 1.1825546872014998
Energy: 1.1665759964983762
Energy: 1.1825546872014998
Energy: 1.1665759965003966
Energy: 1.1825546872014998
Energy: 1.2307509084896937
Energy: 1.2477952367442962
Energy: 1.230750908491209
Energy: 1.2477952367442962
Energy: 1.2307509084907038
Energy: 1.2477952367442962
Energy: 1.1669356393811838
Energy: 1.1501361343014873
Energy: 1.1669356393832042
Energy: 1.1501361343014873
Energy: 1.166935639381689
Energy: 1.150136134300982
Energy: 1.256122066378688
Energy: 1.3090527849500035
Energy: 1.2561220663771726
Energy: 1.3090527849500035
Energy: 1.256122066377678
Energy: 1.3090527849505087
Energy: 1.313779280809528
Energy: 1.1937302585068974
Energy: 1.313779280808518
Energy: 1.1937302585074026
Energy: 1.3137792808105384
Energy: 1.1937302585063925
Energy: 1.1624230851531396
Energy: 1.1302320476536882
Energy: 1.16242308515415
Energy: 1.130232047653183
Energy: 1.1624230851531396
Energy: 1.130232047653183
Energy: 1.3349936342821707
Energy: 1.3186515696818306
Energy: 1.3349936342831807
Energy: 1.3186515696818306
Energy: 1.334993634283686
Energy: 1.3186515696818306
Energy: 1.1010002020336775
Energy: 1.25050787351486
Energy: 1.1010002020301421
Energy: 1.2505078735153652
Energy: 1.1010002020291318
Energy: 1.2505078735153652
Energy: 1.2490735348234079
Energy: 1.2551845222767715
Energy: 1.2490735348229027
Energy: 1.255184522274751
Energy: 1.2490735348249231
Energy: 1.2551845222757614
Energy: 1.2219886092206365
Energy: 1.2006444452349403
Energy: 1.2219886092201315
Energy: 1.2006444452354454
Energy: 1.2219886092206365
Energy: 1.2006444452354454
Energy: 1.1755353170815293
Energy: 1.2487068624876125
Energy: 1.175535317081024
Energy: 1.2487068624876125
Energy: 1.175535317081024
Energy: 1.2487068624871074
Energy: 1.3065303857800068
Energy: 1.1547080669181482
Energy: 1.306530385780512
Energy: 1.154708066917643
Energy: 1.306530385780512
Energy: 1.1547080669181482
Energy: 1.1675671683564965
Energy: 1.1925030124386955
Energy: 1.1675671683554865
Energy: 1.1925030124386955
Energy: 1.1675671683564965
Energy: 1.1925030124386955

minimum gb energy = 1.0742496995903217 eV
minimum distance =  2.31834404451823 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.4271101771420962
Energy: 1.3368496681832434
Energy: 1.4271101771420962
Energy: 1.3368496681846227
Energy: 1.4271101771420962
Energy: 1.3368496681832434
Energy: 1.3254371126938915
Energy: 1.3878593099514125
Energy: 1.3254371126938915
Energy: 1.3878593099500336
Energy: 1.3254371126925124
Energy: 1.3878593099514125
Energy: 1.5601835301592961
Energy: 1.3943233715459702
Energy: 1.5492208154671705
Energy: 1.3943233715459702
Energy: 1.524400468393075
Energy: 1.3943233715459702
Energy: 1.410177492352173
Energy: 1.4554553220051096
Energy: 1.4101774923535517
Energy: 1.4554553220051096
Energy: 1.410177492352173
Energy: 1.4554553220051096
Energy: 1.4474864095866975
Energy: 1.3458595107359708
Energy: 1.4474864095866975
Energy: 1.3458595107373497
Energy: 1.4474864095866975
Energy: 1.3458595107359708
Energy: 1.541691729584192
Energy: 1.4846409719517244
Energy: 1.541691729584192
Energy: 1.4846409719517244
Energy: 1.541691729585571
Energy: 1.4846409719517244
Energy: 1.4349206218241495
Energy: 1.2887756110689794
Energy: 1.4349206218241495
Energy: 1.2887756110662214
Energy: 1.4349206218227706
Energy: 1.2887756110676005
Energy: 1.3992000229785595
Energy: 1.3735576102571978
Energy: 1.3992000229785595
Energy: 1.3735576102571978
Energy: 1.3992000229785595
Energy: 1.3735576102571978
Energy: 1.3288847355423719
Energy: 1.3220494744146616
Energy: 1.328884735543751
Energy: 1.3220494744146616
Energy: 1.328884735540993
Energy: 1.3220494744146616
Energy: 1.4050367784816407
Energy: 1.363821078089115
Energy: 1.4050367784802613
Energy: 1.363821078089115
Energy: 1.4050367784802613
Energy: 1.3638210780904936
Energy: 1.3291622376871375
Energy: 1.3946812685885936
Energy: 1.3291622376871375
Energy: 1.3946812685885936
Energy: 1.3291622376871375
Energy: 1.3946812685885936
Energy: 1.404030698154259
Energy: 1.387971939399818
Energy: 1.404030698155638
Energy: 1.387971939399818
Energy: 1.404030698155638
Energy: 1.387971939399818
Energy: 1.4388357549351913
Energy: 1.4522177421812232
Energy: 1.4388357549351913
Energy: 1.4522177421812232
Energy: 1.4388357549351913
Energy: 1.4522177421812232
Energy: 1.4441663247543322
Energy: 1.385834963894961
Energy: 1.4441663247543322
Energy: 1.385834963894961
Energy: 1.4441663247543322
Energy: 1.3858349638935819

minimum gb energy = 1.2887756110662214 eV
minimum distance =  2.30617863149693 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.6474469621374699
Energy: 1.5819972741020731
Energy: 1.6474469621374699
Energy: 1.5819972741020731
Energy: 1.6474469621374699
Energy: 1.5819972741020731
Energy: 1.444296852123367
Energy: 1.557569918486279
Energy: 1.4442968521239727
Energy: 1.557569918486279
Energy: 1.444296852123367
Energy: 1.557569918486279
Energy: 1.5871088230923012
Energy: 1.5126428050138474
Energy: 1.5871088230904837
Energy: 1.5126428050138474
Energy: 1.5871088230880608
Energy: 1.5126428050138474
Energy: 1.5336121798196873
Energy: 1.4618253185062473
Energy: 1.5336121798196873
Energy: 1.4618253185062473
Energy: 1.5336121798190814
Energy: 1.4618253185062473
Energy: 1.5718393376513071
Energy: 1.5163406957977597
Energy: 1.571839337651913
Energy: 1.5163406957983656
Energy: 1.5718393376525186
Energy: 1.5163406957983656
Energy: 1.5015761349524515
Energy: 1.564838384893579
Energy: 1.5015761349524515
Energy: 1.564838384893579
Energy: 1.5015761349530572
Energy: 1.564838384893579
Energy: 1.537038397135451
Energy: 1.5344607420704839
Energy: 1.5370383971366628
Energy: 1.5344607420704839
Energy: 1.537038397135451
Energy: 1.5344607420704839
Energy: 1.504057524822061
Energy: 1.5279762957247585
Energy: 1.5040575248214554
Energy: 1.527976295725364
Energy: 1.5040575248214554
Energy: 1.527976295725364
Energy: 1.5278229428049648
Energy: 1.5292806739510423
Energy: 1.5278229428049648
Energy: 1.5292806739504365
Energy: 1.5278229428043588
Energy: 1.5292806739510423
Energy: 1.515705623895245
Energy: 1.544722705609235
Energy: 1.5157056238946391
Energy: 1.544722705609235
Energy: 1.515705623895245
Energy: 1.544722705609235
Energy: 1.4742082418812927
Energy: 1.5554860153147225
Energy: 1.4742082418812927
Energy: 1.5554860153147225
Energy: 1.4742082418812927
Energy: 1.5554860153147225
Energy: 1.5499604052112996
Energy: 1.5759639932595368
Energy: 1.549960405213117
Energy: 1.5759639932589309
Energy: 1.549960405212511
Energy: 1.5759639932589309
Energy: 1.527678762979948
Energy: 1.4962085053322711
Energy: 1.527678762979948
Energy: 1.4962085053322711
Energy: 1.5276787629811595
Energy: 1.4962085053322711
Energy: 1.5188431423270816
Energy: 1.536176737773986
Energy: 1.518843142328293
Energy: 1.5361767377733802
Energy: 1.518843142328293
Energy: 1.536176737773986
Energy: 1.484292022058876
Energy: 1.5230941027834144
Energy: 1.4842920220594817
Energy: 1.5230941027828087
Energy: 1.4842920220600875
Energy: 1.5230941027834144
Energy: 1.5399008355901929
Energy: 1.5325409044045133
Energy: 1.5399008355907984
Energy: 1.5325409044045133
Energy: 1.5399008355907984
Energy: 1.5325409044039076
Energy: 1.4634533169894035
Energy: 1.5615158693981437
Energy: 1.4634533169887975
Energy: 1.5615158693981437
Energy: 1.4634533169900092
Energy: 1.5615158693981437
Energy: 1.581120143908972
Energy: 1.6091297601593026
Energy: 1.581120143908972
Energy: 1.609129760158697
Energy: 1.581120143908972
Energy: 1.6091297601593026
Energy: 1.4853681515181973
Energy: 1.4587281417042361
Energy: 1.4853681515175916
Energy: 1.4587281417036304
Energy: 1.4853681515181973
Energy: 1.4587281417042361
Energy: 1.538070672967653
Energy: 1.5202010906997847
Energy: 1.5380706729670472
Energy: 1.5202010907003907
Energy: 1.5380706729670472
Energy: 1.5202010906997847
Energy: 1.4602248579018275
Energy: 1.4925667866958654
Energy: 1.4602248579018275
Energy: 1.4925667866958654
Energy: 1.4602248579012218
Energy: 1.4925667866958654
Energy: 1.5757423580080925
Energy: 1.5981867634106577
Energy: 1.575742358006881
Energy: 1.598186763410052
Energy: 1.5757423580080925
Energy: 1.5981867634106577
Energy: 1.5511009926972532
Energy: 1.5128971538464702
Energy: 1.5511009926972532
Energy: 1.5128971538464702
Energy: 1.5511009926972532
Energy: 1.5128971538464702
Energy: 1.5827401648749204
Energy: 1.5577100160474076
Energy: 1.5827401648749204
Energy: 1.5577100160474076
Energy: 1.5827401648749204
Energy: 1.5577100160468018
Energy: 1.5115573015512067
Energy: 1.5177648517600282
Energy: 1.5115573015512067
Energy: 1.5177648517594222
Energy: 1.5115573015512067
Energy: 1.5177648517600282
Energy: 1.5036090763415282
Energy: 1.5203467446573264
Energy: 1.5036090763415282
Energy: 1.5203467446573264
Energy: 1.5036090763415282
Energy: 1.5203467446573264
Energy: 1.5056866558456778
Energy: 1.5682797293511863
Energy: 1.5056866558468893
Energy: 1.5682797293517923
Energy: 1.5056866558456778
Energy: 1.5682797293517923
Energy: 1.5540399503921338
Energy: 1.4852454114876183
Energy: 1.5540399503927396
Energy: 1.4852454114870124
Energy: 1.5540399503921338
Energy: 1.4852454114876183
Energy: 1.519671080340423
Energy: 1.5668982425743885
Energy: 1.5196710803398175
Energy: 1.5668982425743885
Energy: 1.5196710803410014
Energy: 1.5668982425743885
Energy: 1.4961986127526965
Energy: 1.4315034181436623
Energy: 1.4961986127520908
Energy: 1.4315034181430568
Energy: 1.4961986127520908
Energy: 1.4315034181436623
Energy: 1.5146915800342495
Energy: 1.5985219751052964
Energy: 1.5146915800348553
Energy: 1.5985219751046904
Energy: 1.5146915800348553
Energy: 1.5985219751052964

minimum gb energy = 1.4315034181430568 eV
minimum distance =  2.27552725193752 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.4659482941370934
Energy: 1.4408356460989498
Energy: 1.4659482941360156
Energy: 1.4408356460978717
Energy: 1.4659482941370934
Energy: 1.4408356460989498
Energy: 1.5268072161150283
Energy: 1.7045401799552409
Energy: 1.52680721611395
Energy: 1.7045401799552409
Energy: 1.52680721611395
Energy: 1.7045401799606312
Energy: 1.554890712128087
Energy: 1.5023970837483285
Energy: 1.554890712128087
Energy: 1.5023970837483285
Energy: 1.5548907121205404
Energy: 1.5023970837483285
Energy: 1.4435062976803852
Energy: 1.5716042199407672
Energy: 1.4435062976803852
Energy: 1.5716042199407672
Energy: 1.4435062976803852
Energy: 1.4788637594354448
Energy: 1.5548819983836124
Energy: 1.5024202000045495
Energy: 1.5548819983814561
Energy: 1.5024202000045495
Energy: 1.5548819983846902
Energy: 1.5024202000045495
Energy: 1.5268230163710328
Energy: 1.5919575139663653
Energy: 1.5268230163710328
Energy: 1.5919575139663653
Energy: 1.526823016369955
Energy: 1.4496241897809283
Energy: 1.4659482941381716
Energy: 1.4408356461000278
Energy: 1.4659482941381716
Energy: 1.4408356461000278
Energy: 1.4659482941381716
Energy: 1.4408356461000278
Energy: 1.526807216110716
Energy: 1.7045401799584752
Energy: 1.526807216111794
Energy: 1.7045401799584752
Energy: 1.526807216110716
Energy: 1.7045401799627873
Energy: 1.5548907121259308
Energy: 1.5023970837483285
Energy: 1.5548907121248527
Energy: 1.5023970837494065
Energy: 1.5548907121259308
Energy: 1.5023970837494065
Energy: 1.4435062976814632
Energy: 1.6207089986622796
Energy: 1.4435062976825412
Energy: 1.6207089986622796
Energy: 1.4435062976825412
Energy: 1.6207089986622796
Energy: 1.5548819983857685
Energy: 1.5024202000056273
Energy: 1.5548819983846902
Energy: 1.5024202000056273
Energy: 1.5548819983868463
Energy: 1.5024202000056273
Energy: 1.5268230163667207
Energy: 1.5919575139642093
Energy: 1.5268230163667207
Energy: 1.5919575139652875
Energy: 1.5268230163667207
Energy: 1.5919575139642093
Energy: 1.4659482941370934
Energy: 1.4408356460978717
Energy: 1.4659482941370934
Energy: 1.4408356460978717
Energy: 1.4659482941370934
Energy: 1.4408356460978717
Energy: 1.526807216111794
Energy: 1.704540179957397
Energy: 1.526807216111794
Energy: 1.704540179957397
Energy: 1.5268072161128723
Energy: 1.7045401799638653
Energy: 1.5548907121270088
Energy: 1.5023970837483285
Energy: 1.554890712128087
Energy: 1.5023970837483285
Energy: 1.5548907121216187
Energy: 1.5023970837483285
Energy: 1.443506297679307
Energy: 1.6207089986655137
Energy: 1.443506297679307
Energy: 1.6207089986644356
Energy: 1.4435062976814632
Energy: 1.6207089986655137
Energy: 1.5548819983846902
Energy: 1.5024202000045495
Energy: 1.5548819983825342
Energy: 1.5024202000045495
Energy: 1.5548819983857685
Energy: 1.5024202000045495

minimum gb energy = 1.4408356460978717 eV
minimum distance =  2.3270352961166 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.5889638886250175
Energy: 1.646601997505881
Energy: 1.5889638886250175
Energy: 1.646601997505881
Energy: 1.5889638886250175
Energy: 1.646601997505881
Energy: 1.5708363571058768
Energy: 1.6427428896169627
Energy: 1.5708363571049968
Energy: 1.6427428896169627
Energy: 1.5708363571067572
Energy: 1.6427428896169627
Energy: 1.7037380897821206
Energy: 1.6057179761373148
Energy: 1.6417850376218641
Energy: 1.6057179761373148
Energy: 1.644787661618756
Energy: 1.6057179761373148
Energy: 1.5324840693890982
Energy: 1.6676644098404347
Energy: 1.5324840693882182
Energy: 1.667664409842195
Energy: 1.5324840693890982
Energy: 1.667664409842195
Energy: 1.5499551804264122
Energy: 1.628744044227289
Energy: 1.5499551804264122
Energy: 1.628744044227289
Energy: 1.5499551804264122
Energy: 1.628744044227289
Energy: 1.5821998349250006
Energy: 1.574176850228545
Energy: 1.5821998349250006
Energy: 1.574176850228545
Energy: 1.5821998349250006
Energy: 1.574176850228545
Energy: 1.5305525113260607
Energy: 1.6013220811366395
Energy: 1.5305525113278213
Energy: 1.6013220811366395
Energy: 1.5305525113269411
Energy: 1.6013220811366395
Energy: 1.5388006762472946
Energy: 1.5922068746532767
Energy: 1.5388006762472946
Energy: 1.5922068746532767
Energy: 1.5388006762472946
Energy: 1.5922068746532767
Energy: 1.6732888268348547
Energy: 1.6113816332893929
Energy: 1.6732888268383757
Energy: 1.6113816332893929
Energy: 1.6732888268366153
Energy: 1.6113816332893929
Energy: 1.5598062545200164
Energy: 1.5743171433209115
Energy: 1.5598062545208966
Energy: 1.5743171433200314
Energy: 1.5598062545208966
Energy: 1.5743171433200314
Energy: 1.5866883080219112
Energy: 1.5700055711519976
Energy: 1.5866883080227914
Energy: 1.5700055711519976
Energy: 1.5866883080219112
Energy: 1.5700055711519976
Energy: 1.6539813491010469
Energy: 1.5685735744935405
Energy: 1.6539813490992863
Energy: 1.5685735744935405
Energy: 1.653981349100167
Energy: 1.5685735744935405
Energy: 1.5476172449994916
Energy: 1.6486191648417061
Energy: 1.5476172449994916
Energy: 1.6486191648417061
Energy: 1.5476172449994916
Energy: 1.6486191648417061
Energy: 1.535739477249678
Energy: 1.6387559408200851
Energy: 1.535739477249678
Energy: 1.6387559408200851
Energy: 1.535739477249678
Energy: 1.6387559408200851
Energy: 1.6587948833479278
Energy: 1.5562699580970825
Energy: 1.658794883349688
Energy: 1.5562699580970825
Energy: 1.658794883348808
Energy: 1.5562699580970825
Energy: 1.5980244156628232
Energy: 1.6310182939694975
Energy: 1.598024415661943
Energy: 1.6310182939703781
Energy: 1.5980244156628232
Energy: 1.6310182939703781
Energy: 1.6544702206186936
Energy: 1.6313583137697152
Energy: 1.6544702206178135
Energy: 1.6313583137705954
Energy: 1.6544702206186936
Energy: 1.6313583137697152
Energy: 1.7622812787899207
Energy: 1.5691183080164388
Energy: 1.7622812787899207
Energy: 1.5691183080164388
Energy: 1.7622812787908013
Energy: 1.5691183080155584
Energy: 1.53050769412192
Energy: 1.5789304658907983
Energy: 1.5305076941201596
Energy: 1.5789304658907983
Energy: 1.5305076941210398
Energy: 1.5789304658907983
Energy: 1.6029171445529877
Energy: 1.583454854342395
Energy: 1.6029171445538681
Energy: 1.583454854342395
Energy: 1.6029171445538681
Energy: 1.583454854342395
Energy: 1.6579470845979187
Energy: 1.5662703009563474
Energy: 1.6579470845961586
Energy: 1.5662703009572276
Energy: 1.6579470845979187
Energy: 1.5662703009563474

minimum gb energy = 1.5305076941201596 eV
minimum distance =  2.28028346917585 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.6463094156433804
Energy: 1.6378832871113975
Energy: 1.6042901022526945
Energy: 1.6378832871121392
Energy: 1.6463094156426386
Energy: 1.637883287112881
Energy: 1.636585352337823
Energy: 1.5569358509978
Energy: 1.6365853523348555
Energy: 1.5569358509978
Energy: 1.636585352337823
Energy: 1.5569358509992837
Energy: 1.5367554844193678
Energy: 1.5319613627066766
Energy: 1.5367554844215936
Energy: 1.5319613627066766
Energy: 1.5367554844193678
Energy: 1.5319613627066766
Energy: 1.4886996172765974
Energy: 1.6238430141720528
Energy: 1.4886996172765974
Energy: 1.623843014172795
Energy: 1.4886996172758555
Energy: 1.6238430141779887
Energy: 1.4969769421104715
Energy: 1.575316335505655
Energy: 1.4969769421119554
Energy: 1.5753163355049127
Energy: 1.4969769421112136
Energy: 1.5753163354997193
Energy: 1.5813079823880511
Energy: 1.6138901145187556
Energy: 1.581307982389535
Energy: 1.6138901145180138
Energy: 1.5813079823887932
Energy: 1.6138901145172717
Energy: 1.4949596614104763
Energy: 1.6257668992466052
Energy: 1.4949596614082505
Energy: 1.6257668992458632
Energy: 1.4949596614097345
Energy: 1.625766899248831
Energy: 1.6466969547101318
Energy: 1.585984082730923
Energy: 1.6466969547123578
Energy: 1.585984082730923
Energy: 1.6466969547093897
Energy: 1.5859840827301812
Energy: 1.6812170160950222
Energy: 1.4941477049560234
Energy: 1.6811803602454403
Energy: 1.4941477049560234
Energy: 1.6812170160950222
Energy: 1.4941477049515717
Energy: 1.6300953624896437
Energy: 1.5826475896435
Energy: 1.6299256269909026
Energy: 1.5826475896435
Energy: 1.6300953624889014
Energy: 1.5826475896442418
Energy: 1.625777179526725
Energy: 1.6109104624194448
Energy: 1.6258666857259225
Energy: 1.610910462418703
Energy: 1.625777179526725
Energy: 1.610910462415735
Energy: 1.626522615299545
Energy: 1.4963102503884895
Energy: 1.6265226153017707
Energy: 1.4963102503884895
Energy: 1.626522615299545
Energy: 1.4963102503877477
Energy: 1.5584663836359485
Energy: 1.6261163304765567
Energy: 1.5584663836344645
Energy: 1.6261163304765567
Energy: 1.5584663836359485
Energy: 1.6261163304721051
Energy: 1.488485423481329
Energy: 1.535031648750942
Energy: 1.4884854234828129
Energy: 1.535031648751684
Energy: 1.488485423480587
Energy: 1.53503164875391
Energy: 1.602991535971232
Energy: 1.6151646145226417
Energy: 1.6028391950282315
Energy: 1.6151646145233838
Energy: 1.6029915359727158
Energy: 1.615164614518932
Energy: 1.5379869232514203
Energy: 1.6403312755218862
Energy: 1.5379869232491945
Energy: 1.6403312755218862
Energy: 1.5379869232499361
Energy: 1.64033127552337
Energy: 1.4950714350673868
Energy: 1.5369128259900493
Energy: 1.4950714350666447
Energy: 1.5369128259900493
Energy: 1.4950714350673868
Energy: 1.5369128259930172
Energy: 1.6237721872186954
Energy: 1.5450617373928561
Energy: 1.6237721872201794
Energy: 1.5450617373921143
Energy: 1.6237721872186954
Energy: 1.5450617373928561
Energy: 1.5352833052562576
Energy: 1.533898272212256
Energy: 1.4400472794337185
Energy: 1.533898272212256
Energy: 1.5352833052562576
Energy: 1.533898272212256
Energy: 1.6463094156448643
Energy: 1.6378832871099132
Energy: 1.6042901022519527
Energy: 1.6378832871113975
Energy: 1.6463094156448643
Energy: 1.6378832871091713
Energy: 1.6365853523355975
Energy: 1.5569358509970581
Energy: 1.6365853523326295
Energy: 1.5569358509970581
Energy: 1.6365853523355975
Energy: 1.556935850998542
Energy: 1.5367554844208517
Energy: 1.5319613627089024
Energy: 1.5367554844215936
Energy: 1.5319613627089024
Energy: 1.5367554844208517
Energy: 1.5319613627089024
Energy: 1.4886996172765974
Energy: 1.6238430141698272
Energy: 1.4886996172758555
Energy: 1.6238430141698272
Energy: 1.4886996172765974
Energy: 1.6238430141750206
Energy: 1.4969769421112136
Energy: 1.575316335505655
Energy: 1.4969769421119554
Energy: 1.575316335505655
Energy: 1.4969769421104715
Energy: 1.5753163354989772
Energy: 1.5813079823887932
Energy: 1.6138901145180138
Energy: 1.581307982391761
Energy: 1.6138901145172717
Energy: 1.5813079823887932
Energy: 1.6138901145165299

minimum gb energy = 1.4400472794337185 eV
minimum distance =  2.27948757394232 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.4995460556816116
Energy: 1.5534945423241617
Energy: 1.4995460556816116
Energy: 1.5534945423241617
Energy: 1.4995460556816116
Energy: 1.5534945423241617
Energy: 1.559920214213226
Energy: 1.5320892958279253
Energy: 1.5599202142138664
Energy: 1.532089295827285
Energy: 1.5599202142138664
Energy: 1.5320892958279253
Energy: 1.5575812466655583
Energy: 1.427596832103727
Energy: 1.5575812466655583
Energy: 1.427596832103727
Energy: 1.5575812466655583
Energy: 1.427596832103727
Energy: 1.4468254342696671
Energy: 1.553018441519711
Energy: 1.4468254342696671
Energy: 1.553018441519711
Energy: 1.4468254342690268
Energy: 1.553018441519711
Energy: 1.519029782768604
Energy: 1.5586771162638946
Energy: 1.519029782767323
Energy: 1.5586771162645352
Energy: 1.5190297827679633
Energy: 1.5586771162638946
Energy: 1.5696165952749808
Energy: 1.456915867854216
Energy: 1.5696165952743402
Energy: 1.4569158678535754
Energy: 1.5696165952743402
Energy: 1.4569158678535754
Energy: 1.4301442445144361
Energy: 1.6523042625785025
Energy: 1.4301442445131551
Energy: 1.6523042625785025
Energy: 1.4301442445144361
Energy: 1.6523042625785025
Energy: 1.4853144050671565
Energy: 1.6630491729625267
Energy: 1.4853144050671565
Energy: 1.6630491729625267
Energy: 1.4853144050671565
Energy: 1.6630491729625267
Energy: 1.6213503451930669
Energy: 1.4261849497634687
Energy: 1.6213503451930669
Energy: 1.4261849497634687
Energy: 1.6213503451924263
Energy: 1.4261849497634687
Energy: 1.5582843802649315
Energy: 1.547595423084367
Energy: 1.5582843802649315
Energy: 1.547595423084367
Energy: 1.558284380265572
Energy: 1.547595423084367
Energy: 1.4374174581557047
Energy: 1.6489995315706079
Energy: 1.437417458156345
Energy: 1.6489995315712482
Energy: 1.4374174581557047
Energy: 1.648999531571889
Energy: 1.559615828027785
Energy: 1.4515395206680302
Energy: 1.559615828026504
Energy: 1.4515395206680302
Energy: 1.559615828027785
Energy: 1.4515395206680302
Energy: 1.5442965891700344
Energy: 1.479883634076143
Energy: 1.544296589170675
Energy: 1.479883634076143
Energy: 1.544296589170675
Energy: 1.4798836340755026
Energy: 1.4518650879241712
Energy: 1.5525632322764777
Energy: 1.4518650879248116
Energy: 1.5525632322764777
Energy: 1.4518650879248116
Energy: 1.5525632322777585
Energy: 1.5848527666522902
Energy: 1.4550765783199864
Energy: 1.5848527666522902
Energy: 1.4550765783199864
Energy: 1.5848527666522902
Energy: 1.4550765783199864
Energy: 1.6401978289465975
Energy: 1.4265800198328462
Energy: 1.6401978289465975
Energy: 1.4265800198328462
Energy: 1.6401978289465975
Energy: 1.4265800198328462
Energy: 1.4619997557440965
Energy: 1.544363024279718
Energy: 1.461999755744737
Energy: 1.544363024279718
Energy: 1.461999755744737
Energy: 1.544363024279718
Energy: 1.5318983220462319
Energy: 1.5672526286420836
Energy: 1.5318983220462319
Energy: 1.5672526286420836
Energy: 1.5318983220462319
Energy: 1.5672526286414434
Energy: 1.519172522917045
Energy: 1.4547851459730818
Energy: 1.5191725229176856
Energy: 1.4547851459737224
Energy: 1.5191725229176856
Energy: 1.4547851459737224
Energy: 1.4538575866793
Energy: 1.543200710925405
Energy: 1.4538575866786594
Energy: 1.5432007109260455
Energy: 1.4538575866793
Energy: 1.5432007109260455
Energy: 1.4522721321213075
Energy: 1.6512586298864909
Energy: 1.4522721321213075
Energy: 1.6512586298864909
Energy: 1.452272132120667
Energy: 1.6512586298864909
Energy: 1.6302870232241657
Energy: 1.4479675063434834
Energy: 1.6302870232248061
Energy: 1.4479675063428428
Energy: 1.6302870232241657
Energy: 1.4479675063434834
Energy: 1.6018080740304843
Energy: 1.5425588576847569
Energy: 1.6018080740304843
Energy: 1.5425588576847569
Energy: 1.6018080740304843
Energy: 1.5425588576847569
Energy: 1.4954317245338167
Energy: 1.5587293868078351
Energy: 1.4954317245344573
Energy: 1.5587293868078351
Energy: 1.4954317245338167
Energy: 1.5587293868078351
Energy: 1.5241711393244413
Energy: 1.448417387976844
Energy: 1.5241711393244413
Energy: 1.4484173879774846
Energy: 1.5241711393250819
Energy: 1.448417387976844
Energy: 1.5701707051509615
Energy: 1.4876066267462646
Energy: 1.570170705151602
Energy: 1.4876066267462646
Energy: 1.5701707051509615
Energy: 1.4876066267462646
Energy: 1.431700638681594
Energy: 1.54313516801083
Energy: 1.431700638681594
Energy: 1.5431351680101895
Energy: 1.431700638681594
Energy: 1.5431351680101895
Energy: 1.5733575988105972
Energy: 1.455047582045055
Energy: 1.5733575988105972
Energy: 1.4550475820444146
Energy: 1.5733575988105972
Energy: 1.455047582045055
Energy: 1.5389543162977657
Energy: 1.4548306356029461
Energy: 1.5389543162977657
Energy: 1.4548306356029461
Energy: 1.5389543162984058
Energy: 1.4548306356029461

minimum gb energy = 1.4261849497634687 eV
minimum distance =  2.28400368879185 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.4186769333354836
Energy: 1.5736858262357798
Energy: 1.4186769333354836
Energy: 1.5736858262357798
Energy: 1.4186769333354836
Energy: 1.5736858262357798
Energy: 1.5205363332377986
Energy: 1.4136073939046025
Energy: 1.5205363332327317
Energy: 1.4136073939046025
Energy: 1.5205363332434285
Energy: 1.4136073939040394
Energy: 1.5173805366745488
Energy: 1.3878304882255452
Energy: 1.5173805366739859
Energy: 1.3878304882255452
Energy: 1.5173805366745488
Energy: 1.3878304882249821
Energy: 1.3584039225670361
Energy: 1.5777611390385713
Energy: 1.3584039225681621
Energy: 1.644649241968396
Energy: 1.3584039225664735
Energy: 1.528682719423978
Energy: 1.3809523033625246
Energy: 1.4647251437436823
Energy: 1.3809523033619617
Energy: 1.4647251437431195
Energy: 1.3809523033625246
Energy: 1.4647251437431195
Energy: 1.5284412574933672
Energy: 1.3710191394738007
Energy: 1.528441257494493
Energy: 1.3710191394738007
Energy: 1.5284412574928044
Energy: 1.3710191394738007
Energy: 1.3915193252685614
Energy: 1.50051444630702
Energy: 1.3915193252691243
Energy: 1.50051444630702
Energy: 1.3915193252679983
Energy: 1.5005144463064568
Energy: 1.3565650741359896
Energy: 1.5653550947261412
Energy: 1.3565650741382411
Energy: 1.5653550947250152
Energy: 1.3565650741365525
Energy: 1.5193375139540317
Energy: 1.5277035364388314
Energy: 1.3726847682705967
Energy: 1.5277035364382687
Energy: 1.3726847682700336
Energy: 1.5277035364388314
Energy: 1.3726847682705967
Energy: 1.4416723529700115
Energy: 1.4753848755190289
Energy: 1.4416723529705748
Energy: 1.4450590090015731
Energy: 1.4416723529705748
Energy: 1.491188034632889
Energy: 1.3554433838856463
Energy: 1.6877567668696445
Energy: 1.3554433838839575
Energy: 1.6877567668696445
Energy: 1.3554433838850835
Energy: 1.6877567668696445
Energy: 1.5477426589076986
Energy: 1.4132576219774238
Energy: 1.5477426589093877
Energy: 1.4132576219774238
Energy: 1.5477426589082617
Energy: 1.4132576219774238
Energy: 1.5100407430313514
Energy: 1.3879775079673278
Energy: 1.5100407430313514
Energy: 1.3879775079673278
Energy: 1.5100407430307885
Energy: 1.3879775079673278
Energy: 1.4192285497203165
Energy: 1.5373454303913767
Energy: 1.4192285497191905
Energy: 1.5373454303908136
Energy: 1.4192285497203165
Energy: 1.5373454303908136
Energy: 1.536857539234557
Energy: 1.4516984406008249
Energy: 1.536857539235683
Energy: 1.4516984406008249
Energy: 1.53685753923512
Energy: 1.451698440600262
Energy: 1.5177211670067512
Energy: 1.3911186988981188
Energy: 1.517721167007314
Energy: 1.3911186988981188
Energy: 1.5177211670078772
Energy: 1.3911186988981188
Energy: 1.3559010458729392
Energy: 1.5308575063063141
Energy: 1.3559010458729392
Energy: 1.5308575063063141
Energy: 1.3559010458735021
Energy: 1.5308575063063141
Energy: 1.350171549581411
Energy: 1.5118172914676071
Energy: 1.3501715495802848
Energy: 1.511817291469859
Energy: 1.3501715495797217
Energy: 1.511817291467044
Energy: 1.5276384533950378
Energy: 1.37256142981876
Energy: 1.5276384533944745
Energy: 1.37256142981876
Energy: 1.5276384533950378
Energy: 1.37256142981876
Energy: 1.3917540876851893
Energy: 1.4469009871800176
Energy: 1.3917540876823744
Energy: 1.4469009871800176
Energy: 1.3917540876840633
Energy: 1.4469009871794545
Energy: 1.3774271366771753
Energy: 1.6887794334741644
Energy: 1.3774271366771753
Energy: 1.6887794334747275
Energy: 1.3774271366771753
Energy: 1.6887794334736017
Energy: 1.537180048548315
Energy: 1.370337160742411
Energy: 1.537180048547189
Energy: 1.370337160742411
Energy: 1.5371800485477518
Energy: 1.370337160742411
Energy: 1.547660246956299
Energy: 1.3700297096305114
Energy: 1.547660246954047
Energy: 1.3700297096310743
Energy: 1.54766024695461
Energy: 1.3700297096310743
Energy: 1.3575657570027835
Energy: 1.548955266054584
Energy: 1.3575657570022206
Energy: 1.548955266054584
Energy: 1.3575657570027835
Energy: 1.548955266054584
Energy: 1.4889768543587112
Energy: 1.4537183277431085
Energy: 1.488976854359837
Energy: 1.4537183277431085
Energy: 1.4889768543575854
Energy: 1.4537183277431085
Energy: 1.509642218833495
Energy: 1.3911826550464543
Energy: 1.50964221883068
Energy: 1.3911826550464543
Energy: 1.509642218831243
Energy: 1.3911826550458914
Energy: 1.418953313122171
Energy: 1.5152313144854728
Energy: 1.4189533131227339
Energy: 1.5152313144854728
Energy: 1.418953313122171
Energy: 1.5152313144854728
Energy: 1.4194596378765858
Energy: 1.531744347506452
Energy: 1.4194596378748972
Energy: 1.531744347505889
Energy: 1.4194596378748972
Energy: 1.531744347505889
Energy: 1.549396063629166
Energy: 1.387568829490866
Energy: 1.549396063628603
Energy: 1.3875688294903028
Energy: 1.549396063628603
Energy: 1.3875688294914288
Energy: 1.350249442421469
Energy: 1.4693449307864175
Energy: 1.3502494424209062
Energy: 1.4693449307864175
Energy: 1.3502494424209062
Energy: 1.4693449307864175
Energy: 1.3569068280097036
Energy: 1.484259828750749
Energy: 1.3569068280108296
Energy: 1.484259828750749
Energy: 1.3569068280102665
Energy: 1.484259828750749
Energy: 1.5447751534268832
Energy: 1.370214608632744
Energy: 1.5447751534263203
Energy: 1.3702146086321811
Energy: 1.5447751534268832
Energy: 1.3702146086321811
Energy: 1.5367044581274114
Energy: 1.3699858300402183
Energy: 1.5367044581279743
Energy: 1.3699858300396555
Energy: 1.5367044581262854
Energy: 1.3699858300390921

minimum gb energy = 1.3501715495797217 eV
minimum distance =  2.29688851869455 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.020532982712549077
Energy: 1.1719360041691202
Energy: 0.020532982712549077
Energy: 1.171936004169536
Energy: 0.020532982712549077
Energy: 1.1719360041691202
Energy: 0.021389815564356877
Energy: 0.4601570193626371
Energy: 0.021389815564824645
Energy: 0.4601570193621694
Energy: 0.021389815564824645
Energy: 0.4601570193626371
Energy: 2.0544705663733684
Energy: 0.4594909785163865
Energy: 2.499111263671049
Energy: 0.4594909785287565
Energy: 1.1732410353995808
Energy: 0.4594909785095258
Energy: 0.021389815566175988
Energy: 0.46015701936398856
Energy: 0.021389815566175988
Energy: 0.4601570193635727
Energy: 0.02138981556576019
Energy: 0.46015701936398856

minimum gb energy = 0.020532982712549077 eV
minimum distance =  2.46573227327912 Angstroms
sigma value = 1